1-ethyl-6-fluoranyl-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-5-methyl-7-(3-methyl-1-piperazinyl)-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-5-methyl-7-(3-methylpiperazino)-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C19H21F4N3O3 MolecularWeight: 415.381953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C(C(=C(C(=C21)C(F)(F)F)N3CCNC(C3)C)F)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C(C(=C(C(=C21)C(F)(F)F)N3CCNC(C3)C)F)C)C(=O)O

InChI

InChI=1S/C19H21F4N3O3/c1-4-25-8-11(18(28)29)17(27)12-10(3)14(20)16(13(15(12)25)19(21,22)23)26-6-5-24-9(2)7-26/h8-9,24H,4-7H2,1-3H3,(H,28,29)