7-chloranyl-2-oxidanylidene-5-phenyl-spiro[1H-1,4-benzodiazepine-3,3'-cyclopentane]-1'-carboxylic acid

Systemtic Name: 7-chloranyl-2-oxidanylidene-5-phenyl-spiro[1H-1,4-benzodiazepine-3,3'-cyclopentane]-1'-carboxylic acid Openeye Name: 7-chloro-2-oxo-5-phenyl-spiro[1H-1,4-benzodiazepine-3,3'-cyclopentane]-1'-carboxylic acid CAS Name: 7-chloro-2-oxo-5-phenyl-1'-spiro[1H-1,4-benzodiazepine-3,3'-cyclopentane]carboxylic acid IUPAC Name: 7-chloro-2-oxo-5-phenylspiro[1H-1,4-benzodiazepine-3,3'-cyclopentane]-1'-carboxylic acid Traditional Name: 7-chloro-2-keto-5-phenyl-spiro[1H-1,4-benzodiazepine-3,3'-cyclopentane]-1'-carboxylic acid Formula: C20H17ClN2O3 MolecularWeight: 368.81358

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1C(=O)O)C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

C1CC2(CC1C(=O)O)C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN2O3/c21-14-6-7-16-15(10-14)17(12-4-2-1-3-5-12)23-20(19(26)22-16)9-8-13(11-20)18(24)25/h1-7,10,13H,8-9,11H2,(H,22,26)(H,24,25)