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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[4-(methylamino)phenyl]sulfonylpiperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[4-(methylamino)phenyl]sulfonylpiperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[4-(methylamino)phenyl]sulfonyl-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[4-(methylamino)phenyl]sulfonylpiperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[4-(methylamino)phenyl]sulfonylpiperazino]quinoline-3-carboxylic acid Formula: C24H25FN4O5S MolecularWeight: 500.542503

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=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

CNC1=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/C24H25FN4O5S/c1-26-15-2-6-17(7-3-15)35(33,34)28-10-8-27(9-11-28)22-13-21-18(12-20(22)25)23(30)19(24(31)32)14-29(21)16-4-5-16/h2-3,6-7,12-14,16,26H,4-5,8-11H2,1H3,(H,31,32)