ethyl 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: ethyl 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: ethyl 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 6-(4-chlorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester Formula: C20H15ClN4O4 MolecularWeight: 410.8105

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN4O4/c1-2-29-20(26)19-17-10-22-18(12-3-5-13(21)6-4-12)15-9-14(25(27)28)7-8-16(15)24(17)11-23-19/h3-9,11H,2,10H2,1H3