2-methyl-N-[4-[[methyl(oxan-4-yl)amino]methyl]cyclohexyl]-6-(4-methylphenyl)quinoline-3-carboxamide

Systemtic Name: 2-methyl-N-[4-[[methyl(oxan-4-yl)amino]methyl]cyclohexyl]-6-(4-methylphenyl)quinoline-3-carboxamide Openeye Name: 2-methyl-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]cyclohexyl]-6-(p-tolyl)quinoline-3-carboxamide CAS Name: 2-methyl-N-[4-[[methyl(4-oxanyl)amino]methyl]cyclohexyl]-6-(4-methylphenyl)-3-quinolinecarboxamide IUPAC Name: 2-methyl-N-[4-[[methyl(oxan-4-yl)amino]methyl]cyclohexyl]-6-(4-methylphenyl)quinoline-3-carboxamide Traditional Name: 2-methyl-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]cyclohexyl]-6-(p-tolyl)quinoline-3-carboxamide Formula: C31H39N3O2 MolecularWeight: 485.66026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=CC(=C(N=C3C=C2)C)C(=O)NC4CCC(CC4)CN(C)C5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=CC(=C(N=C3C=C2)C)C(=O)NC4CCC(CC4)CN(C)C5CCOCC5

InChI

InChI=1S/C31H39N3O2/c1-21-4-8-24(9-5-21)25-10-13-30-26(18-25)19-29(22(2)32-30)31(35)33-27-11-6-23(7-12-27)20-34(3)28-14-16-36-17-15-28/h4-5,8-10,13,18-19,23,27-28H,6-7,11-12,14-17,20H2,1-3H3,(H,33,35)