1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[oxolan-2-ylmethyl(phenethylsulfonyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[oxolan-2-ylmethyl(phenethylsulfonyl)amino]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[phenethylsulfonyl(tetrahydrofuran-2-ylmethyl)amino]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[2-oxolanylmethyl(phenethylsulfonyl)amino]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[oxolan-2-ylmethyl(phenethylsulfonyl)amino]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[phenethylsulfonyl(tetrahydrofurfuryl)amino]quinoline-3-carboxylic acid Formula: C26H27FN2O6S MolecularWeight: 514.565783

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)CCC5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)CCC5=CC=CC=C5

InChI

InChI=1S/C26H27FN2O6S/c27-22-13-20-23(28(18-8-9-18)16-21(25(20)30)26(31)32)14-24(22)29(15-19-7-4-11-35-19)36(33,34)12-10-17-5-2-1-3-6-17/h1-3,5-6,13-14,16,18-19H,4,7-12,15H2,(H,31,32)