tert-butyl 10-bromanyl-8-chloranyl-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: tert-butyl 10-bromanyl-8-chloranyl-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: tert-butyl 10-bromo-8-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 10-bromo-8-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 10-bromo-8-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 10-bromo-8-chloro-6-keto-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid tert-butyl ester Formula: C17H17BrClN3O3 MolecularWeight: 426.69218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C2CN(C(=O)C3=CC(=CC(=C3N2C=N1)Br)Cl)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=C2CN(C(=O)C3=CC(=CC(=C3N2C=N1)Br)Cl)C

InChI

InChI=1S/C17H17BrClN3O3/c1-17(2,3)25-16(24)13-12-7-21(4)15(23)10-5-9(19)6-11(18)14(10)22(12)8-20-13/h5-6,8H,7H2,1-4H3