1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[2-pyrrolidin-1-ylethyl(trifluoromethylsulfonyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[2-pyrrolidin-1-ylethyl(trifluoromethylsulfonyl)amino]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[2-pyrrolidin-1-ylethyl(trifluoromethylsulfonyl)amino]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[2-(1-pyrrolidinyl)ethyl-(trifluoromethylsulfonyl)amino]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[2-pyrrolidin-1-ylethyl(trifluoromethylsulfonyl)amino]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[2-pyrrolidinoethyl(triflyl)amino]quinoline-3-carboxylic acid Formula: C20H21F4N3O5S MolecularWeight: 491.456453

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1CCN(C1)CCN(C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C20H21F4N3O5S/c21-15-9-13-16(26(12-3-4-12)11-14(18(13)28)19(29)30)10-17(15)27(33(31,32)20(22,23)24)8-7-25-5-1-2-6-25/h9-12H,1-8H2,(H,29,30)