ethyl 7-cyano-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: ethyl 7-cyano-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: ethyl 7-cyano-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 7-cyano-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-cyano-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 7-cyano-6-keto-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CN(C(=O)C3=C(C=CC=C3N2C=N1)C#N)C

Isomeric SMILES

CCOC(=O)C1=C2CN(C(=O)C3=C(C=CC=C3N2C=N1)C#N)C

InChI

InChI=1S/C16H14N4O3/c1-3-23-16(22)14-12-8-19(2)15(21)13-10(7-17)5-4-6-11(13)20(12)9-18-14/h4-6,9H,3,8H2,1-2H3