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        "molfile": "\n  Marvin  01132107592D          \n\n 23 23  0  0  0  0            999 V2000\n   -1.0114   -1.4397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.0114   -2.2705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2941   -3.4832    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2941   -1.0321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7235   -1.0321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.4434   -1.4397    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2941   -2.6576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.2941   -0.2039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.3974   -1.4397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1146   -1.0321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.3974    0.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.1146   -0.2039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.9649   -3.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.3509   -3.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1555   -1.0321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -1.7235   -0.2039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    1.8345    0.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    0.1110   -4.7475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -0.7095   -4.7475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -3.1555   -0.2039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   -2.4434    0.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n    2.4305   -1.0321    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0\n    3.7412   -1.0372    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n  2  1  2  0  0  0  0\n  3  7  1  0  0  0  0\n  4  1  1  0  0  0  0\n  5  1  1  0  0  0  0\n  6  5  1  0  0  0  0\n  7  2  1  0  0  0  0\n  8  4  2  0  0  0  0\n  9  4  1  0  0  0  0\n 10  9  2  0  0  0  0\n 11  8  1  0  0  0  0\n 12 10  1  0  0  0  0\n 13  3  1  0  0  0  0\n 14  3  1  0  0  0  0\n 15  6  2  0  0  0  0\n 16  5  2  0  0  0  0\n 17 12  1  0  0  0  0\n 18 14  1  0  0  0  0\n 19 13  1  0  0  0  0\n 20 21  2  0  0  0  0\n 21 16  1  0  0  0  0\n 20 15  1  0  0  0  0\n 12 11  2  0  0  0  0\n 19 18  1  0  0  0  0\nM  END",
        "smiles": "Cc1ccc(cc1)/C(=C\\CN2CCCC2)/c3ccccn3.Cl.O",
        "formula": "C19H22N2.ClH.H2O",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ACHIRAL",
        "defined_stereo": 0,
        "ez_centers": 1,
        "molecular_weight": "332.8682",
        "optical_activity": "NONE",
        "references": [
          "e63bd78b-edd2-429e-bcd5-fb8dbb77e2b1",
          "b8a4de8b-0dc8-42e8-b4d7-df55d6bec46b"
        ],
        "stereo_centers": 0
      },
      "unii": "YAN7R5L890"
    }
  ]
}