(phenylmethyl) 6-oxidanylidene-2,5-dihydro-1H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxylate

Systemtic Name: (phenylmethyl) 6-oxidanylidene-2,5-dihydro-1H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxylate Openeye Name: benzyl 6-oxo-2,5-dihydro-1H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxylate CAS Name: 6-oxo-2,5-dihydro-1H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-oxo-2,5-dihydro-1H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxylate Traditional Name: 6-keto-2,5-dihydro-1H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxylic acid benzyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2=C(N1)N(C3=CC=CC=C3C(=O)N2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C=CC2=C(N1)N(C3=CC=CC=C3C(=O)N2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3/c24-19-15-9-4-5-11-17(15)23(18-16(22-19)10-6-12-21-18)20(25)26-13-14-7-2-1-3-8-14/h1-11,21H,12-13H2,(H,22,24)