methyl 8-chloranyl-1,4-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: methyl 8-chloranyl-1,4-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: methyl 8-chloro-1,4-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 8-chloro-1,4-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 8-chloro-1,4-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 8-chloro-1,4-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid methyl ester Formula: C21H18ClN3O2 MolecularWeight: 379.83952

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(N=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4)C)C(=O)OC

Isomeric SMILES

CC1C2=C(N=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4)C)C(=O)OC

InChI

InChI=1S/C21H18ClN3O2/c1-12-20-19(21(26)27-3)24-13(2)25(20)17-10-9-15(22)11-16(17)18(23-12)14-7-5-4-6-8-14/h4-12H,1-3H3