[2-[methyl-(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 4-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: [2-[methyl-(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 4-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: [2-[methyl-(4-methylcyclohexyl)amino]-2-oxo-ethyl] 4-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(trifluoromethyl)-3-quinolinecarboxylic acid [2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl] 4-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(trifluoromethyl)quinoline-3-carboxylic acid [2-keto-2-[methyl-(4-methylcyclohexyl)amino]ethyl] ester Formula: C21H23F3N2O3 MolecularWeight: 408.41413

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N(C)C(=O)COC(=O)C2=C(C3=CC=CC=C3N=C2)C(F)(F)F

Isomeric SMILES

CC1CCC(CC1)N(C)C(=O)COC(=O)C2=C(C3=CC=CC=C3N=C2)C(F)(F)F

InChI

InChI=1S/C21H23F3N2O3/c1-13-7-9-14(10-8-13)26(2)18(27)12-29-20(28)16-11-25-17-6-4-3-5-15(17)19(16)21(22,23)24/h3-6,11,13-14H,7-10,12H2,1-2H3