3-cyclohexyl-5-methyl-7-[[2-(trifluoromethyloxy)phenyl]methyl]quinoline-2,4,6-triamine

Systemtic Name: 3-cyclohexyl-5-methyl-7-[[2-(trifluoromethyloxy)phenyl]methyl]quinoline-2,4,6-triamine Openeye Name: 3-cyclohexyl-5-methyl-7-[[2-(trifluoromethoxy)phenyl]methyl]quinoline-2,4,6-triamine CAS Name: 3-cyclohexyl-5-methyl-7-[[2-(trifluoromethoxy)phenyl]methyl]quinoline-2,4,6-triamine IUPAC Name: 3-cyclohexyl-5-methyl-7-[[2-(trifluoromethoxy)phenyl]methyl]quinoline-2,4,6-triamine Traditional Name: [2,4-diamino-3-cyclohexyl-5-methyl-7-[2-(trifluoromethoxy)benzyl]-6-quinolyl]amine Formula: C24H27F3N4O MolecularWeight: 444.49259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C1C(=C(C(=N2)N)C3CCCCC3)N)CC4=CC=CC=C4OC(F)(F)F)N

Isomeric SMILES

CC1=C(C(=CC2=C1C(=C(C(=N2)N)C3CCCCC3)N)CC4=CC=CC=C4OC(F)(F)F)N

InChI

InChI=1S/C24H27F3N4O/c1-13-19-17(31-23(30)20(22(19)29)14-7-3-2-4-8-14)12-16(21(13)28)11-15-9-5-6-10-18(15)32-24(25,26)27/h5-6,9-10,12,14H,2-4,7-8,11,28H2,1H3,(H4,29,30,31)