N-(4-methylcyclohexyl)-6-oxidanylidene-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide

Systemtic Name: N-(4-methylcyclohexyl)-6-oxidanylidene-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Openeye Name: N-(4-methylcyclohexyl)-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide CAS Name: N-(4-methylcyclohexyl)-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide IUPAC Name: N-(4-methylcyclohexyl)-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Traditional Name: 6-keto-N-(4-methylcyclohexyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC1CCC(CC1)NC(=O)C2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C21H23N3O2/c1-13-6-9-15(10-7-13)22-20(25)14-8-11-18-19(12-14)24-21(26)16-4-2-3-5-17(16)23-18/h2-5,8,11-13,15,23H,6-7,9-10H2,1H3,(H,22,25)(H,24,26)