7-[4-(2-carboxyphenyl)carbonylpiperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(2-carboxyphenyl)carbonylpiperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(2-carboxybenzoyl)piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[(2-carboxyphenyl)-oxomethyl]-1-piperazinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(2-carboxybenzoyl)piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(2-carboxybenzoyl)piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C25H22FN3O6 MolecularWeight: 479.457083

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)C5=CC=CC=C5C(=O)O)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)C5=CC=CC=C5C(=O)O)F)C(=O)O

InChI

InChI=1S/C25H22FN3O6/c26-19-11-17-20(29(14-5-6-14)13-18(22(17)30)25(34)35)12-21(19)27-7-9-28(10-8-27)23(31)15-3-1-2-4-16(15)24(32)33/h1-4,11-14H,5-10H2,(H,32,33)(H,34,35)