1-(phenylmethyl)-4-[2-[3-(trifluoromethyl)phenyl]sulfonylpropan-2-yl]piperidin-2-one

Systemtic Name: 1-(phenylmethyl)-4-[2-[3-(trifluoromethyl)phenyl]sulfonylpropan-2-yl]piperidin-2-one Openeye Name: 1-benzyl-4-[1-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-ethyl]piperidin-2-one CAS Name: 1-(phenylmethyl)-4-[2-[3-(trifluoromethyl)phenyl]sulfonylpropan-2-yl]-2-piperidinone IUPAC Name: 1-benzyl-4-[2-[3-(trifluoromethyl)phenyl]sulfonylpropan-2-yl]piperidin-2-one Traditional Name: 1-benzyl-4-[1-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-ethyl]-2-piperidone Formula: C22H24F3NO3S MolecularWeight: 439.49107

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCN(C(=O)C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C1CCN(C(=O)C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H24F3NO3S/c1-21(2,30(28,29)19-10-6-9-18(13-19)22(23,24)25)17-11-12-26(20(27)14-17)15-16-7-4-3-5-8-16/h3-10,13,17H,11-12,14-15H2,1-2H3