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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[(4-methoxyphenyl)sulfonyl-(oxolan-2-ylmethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[(4-methoxyphenyl)sulfonyl-(tetrahydrofuran-2-ylmethyl)amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[(4-methoxyphenyl)sulfonyl-(2-oxolanylmethyl)amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[(4-methoxyphenyl)sulfonyl-(oxolan-2-ylmethyl)amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[(4-methoxyphenyl)sulfonyl-(tetrahydrofurfuryl)amino]quinoline-3-carboxylic acid Formula: C25H25FN2O7S MolecularWeight: 516.538603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCO2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2CCCO2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F

InChI

InChI=1S/C25H25FN2O7S/c1-34-16-6-8-18(9-7-16)36(32,33)28(13-17-3-2-10-35-17)23-12-22-19(11-21(23)26)24(29)20(25(30)31)14-27(22)15-4-5-15/h6-9,11-12,14-15,17H,2-5,10,13H2,1H3,(H,30,31)