tert-butyl 8-ethoxy-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: tert-butyl 8-ethoxy-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: tert-butyl 8-ethoxy-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 8-ethoxy-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-ethoxy-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 8-ethoxy-6-keto-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid tert-butyl ester Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N3C=NC(=C3CN(C2=O)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N3C=NC(=C3CN(C2=O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H23N3O4/c1-6-25-12-7-8-14-13(9-12)17(23)21(5)10-15-16(20-11-22(14)15)18(24)26-19(2,3)4/h7-9,11H,6,10H2,1-5H3