7-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-1-ethyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-1-ethyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-1-ethyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-(4-aminophenyl)sulfonyl-1-piperazinyl]-1-ethyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]-1-ethyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-8-methoxy-7-(4-sulfanilylpiperazino)quinoline-3-carboxylic acid Formula: C23H25FN4O6S MolecularWeight: 504.531203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OC)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)N)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OC)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)N)F)C(=O)O

InChI

InChI=1S/C23H25FN4O6S/c1-3-26-13-17(23(30)31)21(29)16-12-18(24)20(22(34-2)19(16)26)27-8-10-28(11-9-27)35(32,33)15-6-4-14(25)5-7-15/h4-7,12-13H,3,8-11,25H2,1-2H3,(H,30,31)