7-[4-[2-(2-chlorophenyl)ethanoyl]piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[2-(2-chlorophenyl)ethanoyl]piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-[2-(2-chlorophenyl)acetyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[2-(2-chlorophenyl)-1-oxoethyl]-1-piperazinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-[2-(2-chlorophenyl)acetyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-[2-(2-chlorophenyl)acetyl]piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C25H23ClFN3O4 MolecularWeight: 483.919223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)CC5=CC=CC=C5Cl)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)CC5=CC=CC=C5Cl)F)C(=O)O

InChI

InChI=1S/C25H23ClFN3O4/c26-19-4-2-1-3-15(19)11-23(31)29-9-7-28(8-10-29)22-13-21-17(12-20(22)27)24(32)18(25(33)34)14-30(21)16-5-6-16/h1-4,12-14,16H,5-11H2,(H,33,34)