8-bromanyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid

Systemtic Name: 8-bromanyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Openeye Name: 8-bromo-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid CAS Name: 8-bromo-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid IUPAC Name: 8-bromo-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Traditional Name: 8-bromo-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Formula: C18H12BrN3O2 MolecularWeight: 382.21078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N=CN2C3=C(C=C(C=C3)Br)C(=N1)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C2=C(N=CN2C3=C(C=C(C=C3)Br)C(=N1)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C18H12BrN3O2/c19-12-6-7-14-13(8-12)16(11-4-2-1-3-5-11)20-9-15-17(18(23)24)21-10-22(14)15/h1-8,10H,9H2,(H,23,24)