ethyl 6-(2,2-diethoxyethylamino)-8-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: ethyl 6-(2,2-diethoxyethylamino)-8-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: ethyl 6-(2,2-diethoxyethylamino)-8-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 6-(2,2-diethoxyethylamino)-8-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2,2-diethoxyethylamino)-8-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 6-(2,2-diethoxyethylamino)-8-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC1=NCC2=C(N=CN2C3=C1C=C(C=C3)C)C(=O)OCC)OCC

Isomeric SMILES

CCOC(CNC1=NCC2=C(N=CN2C3=C1C=C(C=C3)C)C(=O)OCC)OCC

InChI

InChI=1S/C21H28N4O4/c1-5-27-18(28-6-2)12-23-20-15-10-14(4)8-9-16(15)25-13-24-19(17(25)11-22-20)21(26)29-7-3/h8-10,13,18H,5-7,11-12H2,1-4H3,(H,22,23)