6-chloranyl-1-cyclopropyl-8-fluoranyl-7-[3-(4-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-cyclopropyl-8-fluoranyl-7-[3-(4-methoxyphenyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-chloro-1-cyclopropyl-8-fluoro-7-[3-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-chloro-1-cyclopropyl-8-fluoro-7-[3-(4-methoxyphenyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-1-cyclopropyl-8-fluoro-7-[3-(4-methoxyphenyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-chloro-1-cyclopropyl-8-fluoro-4-keto-7-[3-(4-methoxyphenyl)piperazino]quinoline-3-carboxylic acid Formula: C24H23ClFN3O4 MolecularWeight: 471.908523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CN(CCN2)C3=C(C=C4C(=C3F)N(C=C(C4=O)C(=O)O)C5CC5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2CN(CCN2)C3=C(C=C4C(=C3F)N(C=C(C4=O)C(=O)O)C5CC5)Cl

InChI

InChI=1S/C24H23ClFN3O4/c1-33-15-6-2-13(3-7-15)19-12-28(9-8-27-19)22-18(25)10-16-21(20(22)26)29(14-4-5-14)11-17(23(16)30)24(31)32/h2-3,6-7,10-11,14,19,27H,4-5,8-9,12H2,1H3,(H,31,32)