1-cyclopropyl-6-fluoranyl-7-[3-methyl-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[3-methyl-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[3-methyl-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[3-methyl-3-(methylaminomethyl)-1-pyrrolidinyl]-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[3-methyl-3-(methylaminomethyl)pyrrolidin-1-yl]-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[3-methyl-3-(methylaminomethyl)pyrrolidino]-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C21H23F4N3O3 MolecularWeight: 441.419233

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)C4CC4)F)CNC

Isomeric SMILES

CC1(CCN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)C4CC4)F)CNC

InChI

InChI=1S/C21H23F4N3O3/c1-20(9-26-2)5-6-27(10-20)17-14(22)7-12-16(15(17)21(23,24)25)28(11-3-4-11)8-13(18(12)29)19(30)31/h7-8,11,26H,3-6,9-10H2,1-2H3,(H,30,31)