7-(3-azanylpiperidin-1-yl)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpiperidin-1-yl)-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-1-piperidyl)-1-cyclopropyl-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-piperidinyl)-1-cyclopropyl-6-fluoro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopiperidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 7-(3-aminopiperidino)-1-cyclopropyl-6-fluoro-4-keto-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C19H19F4N3O3 MolecularWeight: 413.366073

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)C4CC4)F)N

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)C4CC4)F)N

InChI

InChI=1S/C19H19F4N3O3/c20-13-6-11-15(26(10-3-4-10)8-12(17(11)27)18(28)29)14(19(21,22)23)16(13)25-5-1-2-9(24)7-25/h6,8-10H,1-5,7,24H2,(H,28,29)