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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[naphthalen-2-ylsulfonyl(oxolan-2-ylmethyl)amino]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[2-naphthylsulfonyl(tetrahydrofuran-2-ylmethyl)amino]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[2-naphthalenylsulfonyl(2-oxolanylmethyl)amino]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[naphthalen-2-ylsulfonyl(oxolan-2-ylmethyl)amino]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[2-naphthylsulfonyl(tetrahydrofurfuryl)amino]quinoline-3-carboxylic acid Formula: C28H25FN2O6S MolecularWeight: 536.571303

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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)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CC(OC1)CN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C28H25FN2O6S/c29-24-13-22-25(30(19-8-9-19)16-23(27(22)32)28(33)34)14-26(24)31(15-20-6-3-11-37-20)38(35,36)21-10-7-17-4-1-2-5-18(17)12-21/h1-2,4-5,7,10,12-14,16,19-20H,3,6,8-9,11,15H2,(H,33,34)