7-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-1-cyclopropyl-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(5-chloranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-1-cyclopropyl-8-methyl-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]-1-cyclopropyl-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-1-cyclopropyl-8-methyl-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(5-chloro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]-1-cyclopropyl-8-methyl-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(5-chloro-2-keto-3H-benzimidazol-1-yl)piperidino]-1-cyclopropyl-4-keto-8-methyl-6-nitro-quinoline-3-carboxylic acid Formula: C26H24ClN5O6 MolecularWeight: 537.95166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1N3CCC(CC3)N4C5=C(C=C(C=C5)Cl)NC4=O)[N+](=O)[O-])C(=O)C(=CN2C6CC6)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1N3CCC(CC3)N4C5=C(C=C(C=C5)Cl)NC4=O)[N+](=O)[O-])C(=O)C(=CN2C6CC6)C(=O)O

InChI

InChI=1S/C26H24ClN5O6/c1-13-22-17(24(33)18(25(34)35)12-30(22)15-3-4-15)11-21(32(37)38)23(13)29-8-6-16(7-9-29)31-20-5-2-14(27)10-19(20)28-26(31)36/h2,5,10-12,15-16H,3-4,6-9H2,1H3,(H,28,36)(H,34,35)