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

Systemtic Name: N-[(4-methylphenyl)methyl]-6-oxidanylidene-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Openeye Name: 6-oxo-N-(p-tolylmethyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-6-oxo-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Traditional Name: 6-keto-N-(4-methylbenzyl)-5,11-dihydrobenzo[b][1,4]benzodiazepine-3-carboxamide Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C22H19N3O2/c1-14-6-8-15(9-7-14)13-23-21(26)16-10-11-19-20(12-16)25-22(27)17-4-2-3-5-18(17)24-19/h2-12,24H,13H2,1H3,(H,23,26)(H,25,27)