1-cyclopropyl-7-[4-(4-dimethylaminophenyl)sulfonylpiperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(4-dimethylaminophenyl)sulfonylpiperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(4-dimethylaminophenyl)sulfonylpiperazin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-(4-dimethylaminophenyl)sulfonyl-1-piperazinyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(4-dimethylaminophenyl)sulfonylpiperazin-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[4-(4-dimethylaminophenyl)sulfonylpiperazino]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C25H27FN4O5S MolecularWeight: 514.569083

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C25H27FN4O5S/c1-27(2)16-5-7-18(8-6-16)36(34,35)29-11-9-28(10-12-29)23-14-22-19(13-21(23)26)24(31)20(25(32)33)15-30(22)17-3-4-17/h5-8,13-15,17H,3-4,9-12H2,1-2H3,(H,32,33)