Molecule ID: 23691043

IUPAC Name: potassium;7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylate

Description: The molecule is the potassium salt of clorazepic acid. It has a role as an anxiolytic drug and a prodrug. It contains a clorazepic acid anion.

SMILES: O=C(O)C1N=C(c2ccccc2)c2cc(Cl)ccc2N=C1[O-].[K+]

SELFIES: [O][=C][Branch1][C][O][C][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][=C][Ring2][Ring1][C][O-1].[K+1]

InChI: InChI=1S/C16H11ClN2O3.K/c17-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)19-14(16(21)22)15(20)18-12;/h1-8,14H,(H,18,20)(H,21,22);/q;+1/p-1

Molecular Properties:
- Polar Surface Area: 81.6 Ų
- LogP: nan