8-fluoranyl-6-(2-iodanylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid

Systemtic Name: 8-fluoranyl-6-(2-iodanylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Openeye Name: 8-fluoro-6-(2-iodophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid CAS Name: 8-fluoro-6-(2-iodophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid IUPAC Name: 8-fluoro-6-(2-iodophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Traditional Name: 8-fluoro-6-(2-iodophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Formula: C18H11FIN3O2 MolecularWeight: 447.201713

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N=CN2C3=C(C=C(C=C3)F)C(=N1)C4=CC=CC=C4I)C(=O)O

Isomeric SMILES

C1C2=C(N=CN2C3=C(C=C(C=C3)F)C(=N1)C4=CC=CC=C4I)C(=O)O

InChI

InChI=1S/C18H11FIN3O2/c19-10-5-6-14-12(7-10)16(11-3-1-2-4-13(11)20)21-8-15-17(18(24)25)22-9-23(14)15/h1-7,9H,8H2,(H,24,25)