(1,3-dimethylpiperidin-4-yl) 6-oxidanylidene-5H-benzo[b][1,4]benzodiazepine-11-carboxylate

Systemtic Name: (1,3-dimethylpiperidin-4-yl) 6-oxidanylidene-5H-benzo[b][1,4]benzodiazepine-11-carboxylate Openeye Name: (1,3-dimethyl-4-piperidyl) 6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxylate CAS Name: 6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxylic acid (1,3-dimethyl-4-piperidinyl) ester IUPAC Name: (1,3-dimethylpiperidin-4-yl) 6-oxo-5H-benzo[b][1,4]benzodiazepine-11-carboxylate Traditional Name: 6-keto-5H-benzo[b][1,4]benzodiazepine-11-carboxylic acid (1,3-dimethyl-4-piperidyl) ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1OC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42)C

Isomeric SMILES

CC1CN(CCC1OC(=O)N2C3=CC=CC=C3C(=O)NC4=CC=CC=C42)C

InChI

InChI=1S/C21H23N3O3/c1-14-13-23(2)12-11-19(14)27-21(26)24-17-9-5-3-7-15(17)20(25)22-16-8-4-6-10-18(16)24/h3-10,14,19H,11-13H2,1-2H3,(H,22,25)