ethyl 7,8-dimethoxy-1-(2-methylphenyl)-5-oxidanylidene-2,3-benzodiazepine-4-carboxylate

Systemtic Name: ethyl 7,8-dimethoxy-1-(2-methylphenyl)-5-oxidanylidene-2,3-benzodiazepine-4-carboxylate Openeye Name: ethyl 7,8-dimethoxy-1-(o-tolyl)-5-oxo-2,3-benzodiazepine-4-carboxylate CAS Name: 7,8-dimethoxy-1-(2-methylphenyl)-5-oxo-2,3-benzodiazepine-4-carboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dimethoxy-1-(2-methylphenyl)-5-oxo-2,3-benzodiazepine-4-carboxylate Traditional Name: 5-keto-7,8-dimethoxy-1-(o-tolyl)-2,3-benzodiazepine-4-carboxylic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN=C(C2=CC(=C(C=C2C1=O)OC)OC)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=NN=C(C2=CC(=C(C=C2C1=O)OC)OC)C3=CC=CC=C3C

InChI

InChI=1S/C21H20N2O5/c1-5-28-21(25)19-20(24)15-11-17(27-4)16(26-3)10-14(15)18(22-23-19)13-9-7-6-8-12(13)2/h6-11H,5H2,1-4H3