4-[3-methyl-5-(trifluoromethyl)phenyl]-1-phenyl-1-[4-(pyridin-2-ylamino)piperidin-1-yl]butan-2-one

Systemtic Name: 4-[3-methyl-5-(trifluoromethyl)phenyl]-1-phenyl-1-[4-(pyridin-2-ylamino)piperidin-1-yl]butan-2-one Openeye Name: 4-[3-methyl-5-(trifluoromethyl)phenyl]-1-phenyl-1-[4-(2-pyridylamino)-1-piperidyl]butan-2-one CAS Name: 4-[3-methyl-5-(trifluoromethyl)phenyl]-1-phenyl-1-[4-(2-pyridinylamino)-1-piperidinyl]-2-butanone IUPAC Name: 4-[3-methyl-5-(trifluoromethyl)phenyl]-1-phenyl-1-[4-(pyridin-2-ylamino)piperidin-1-yl]butan-2-one Traditional Name: 4-[3-methyl-5-(trifluoromethyl)phenyl]-1-phenyl-1-[4-(2-pyridylamino)piperidino]butan-2-one Formula: C28H30F3N3O MolecularWeight: 481.55251

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(F)(F)F)CCC(=O)C(C2=CC=CC=C2)N3CCC(CC3)NC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=CC(=C1)C(F)(F)F)CCC(=O)C(C2=CC=CC=C2)N3CCC(CC3)NC4=CC=CC=N4

InChI

InChI=1S/C28H30F3N3O/c1-20-17-21(19-23(18-20)28(29,30)31)10-11-25(35)27(22-7-3-2-4-8-22)34-15-12-24(13-16-34)33-26-9-5-6-14-32-26/h2-9,14,17-19,24,27H,10-13,15-16H2,1H3,(H,32,33)