methyl 4-methyl-1-(4-methylphenyl)-2,3-bis(oxidanylidene)-5,10-dihydropyrrolo[2,3-b][1,5]benzodiazepine-10a-carboxylate

Systemtic Name: methyl 4-methyl-1-(4-methylphenyl)-2,3-bis(oxidanylidene)-5,10-dihydropyrrolo[2,3-b][1,5]benzodiazepine-10a-carboxylate Openeye Name: methyl 4-methyl-2,3-dioxo-1-(p-tolyl)-5,10-dihydropyrrolo[2,3-b][1,5]benzodiazepine-10a-carboxylate CAS Name: 4-methyl-1-(4-methylphenyl)-2,3-dioxo-5,10-dihydropyrrolo[2,3-b][1,5]benzodiazepine-10a-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-1-(4-methylphenyl)-2,3-dioxo-5,10-dihydropyrrolo[2,3-b][1,5]benzodiazepine-10a-carboxylate Traditional Name: 2,3-diketo-4-methyl-1-(p-tolyl)-5,10-dihydropyrrolo[2,3-b][1,5]benzodiazepine-10a-carboxylic acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=O)C3=C(NC4=CC=CC=C4NC32C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=O)C3=C(NC4=CC=CC=C4NC32C(=O)OC)C

InChI

InChI=1S/C21H19N3O4/c1-12-8-10-14(11-9-12)24-19(26)18(25)17-13(2)22-15-6-4-5-7-16(15)23-21(17,24)20(27)28-3/h4-11,22-23H,1-3H3