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

Systemtic Name: 6-(2-fluorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Openeye Name: 6-(2-fluorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid CAS Name: 6-(2-fluorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid IUPAC Name: 6-(2-fluorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Traditional Name: 6-(2-fluorophenyl)-8-nitro-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid Formula: C18H11FN4O4 MolecularWeight: 366.302743

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N=CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=C4F)C(=O)O

Isomeric SMILES

C1C2=C(N=CN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CC=C4F)C(=O)O

InChI

InChI=1S/C18H11FN4O4/c19-13-4-2-1-3-11(13)16-12-7-10(23(26)27)5-6-14(12)22-9-21-17(18(24)25)15(22)8-20-16/h1-7,9H,8H2,(H,24,25)