3-pyridin-4-yl-1-[(3S)-3-[4-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-pyridin-4-yl-1-[(3S)-3-[4-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-(4-pyridyl)-1-[(3S)-3-[4-(trifluoromethyl)benzoyl]-1-piperidyl]propan-1-one CAS Name: 1-[(3S)-3-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperidinyl]-3-pyridin-4-yl-1-propanone IUPAC Name: 3-pyridin-4-yl-1-[(3S)-3-[4-(trifluoromethyl)benzoyl]piperidin-1-yl]propan-1-one Traditional Name: 3-(4-pyridyl)-1-[(3S)-3-[4-(trifluoromethyl)benzoyl]piperidino]propan-1-one Formula: C21H21F3N2O2 MolecularWeight: 390.39885

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCC2=CC=NC=C2)C(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H21F3N2O2/c22-21(23,24)18-6-4-16(5-7-18)20(28)17-2-1-13-26(14-17)19(27)8-3-15-9-11-25-12-10-15/h4-7,9-12,17H,1-3,8,13-14H2/t17-/m0/s1