7-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-1-(4-fluorophenyl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-1-(4-fluorophenyl)-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]-1-(4-fluorophenyl)-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-1-(4-fluorophenyl)-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]-1-(4-fluorophenyl)-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(5-chloro-2-keto-3H-benzimidazol-1-yl)piperidino]-1-(4-fluorophenyl)-4-keto-6-nitro-quinoline-3-carboxylic acid Formula: C28H21ClFN5O6 MolecularWeight: 577.947643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)C4=C(C=C5C(=C4)N(C=C(C5=O)C(=O)O)C6=CC=C(C=C6)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)C4=C(C=C5C(=C4)N(C=C(C5=O)C(=O)O)C6=CC=C(C=C6)F)[N+](=O)[O-]

InChI

InChI=1S/C28H21ClFN5O6/c29-15-1-6-22-21(11-15)31-28(39)34(22)18-7-9-32(10-8-18)24-13-23-19(12-25(24)35(40)41)26(36)20(27(37)38)14-33(23)17-4-2-16(30)3-5-17/h1-6,11-14,18H,7-10H2,(H,31,39)(H,37,38)