2,2-dimethyl-6-[(3S)-3-[3-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]carbonyl-3H-pyran-4-one

Systemtic Name: 2,2-dimethyl-6-[(3S)-3-[3-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]carbonyl-3H-pyran-4-one Openeye Name: 2,2-dimethyl-6-[(3S)-3-[3-(trifluoromethyl)benzoyl]piperidine-1-carbonyl]-3H-pyran-4-one CAS Name: 2,2-dimethyl-6-[oxo-[(3S)-3-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperidinyl]methyl]-3H-pyran-4-one IUPAC Name: 2,2-dimethyl-6-[(3S)-3-[3-(trifluoromethyl)benzoyl]piperidine-1-carbonyl]-3H-pyran-4-one Traditional Name: 2,2-dimethyl-6-[(3S)-3-[3-(trifluoromethyl)benzoyl]piperidine-1-carbonyl]-3H-pyran-4-one Formula: C21H22F3NO4 MolecularWeight: 409.39889

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C=C(O1)C(=O)N2CCCC(C2)C(=O)C3=CC(=CC=C3)C(F)(F)F)C

Isomeric SMILES

CC1(CC(=O)C=C(O1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC(=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C21H22F3NO4/c1-20(2)11-16(26)10-17(29-20)19(28)25-8-4-6-14(12-25)18(27)13-5-3-7-15(9-13)21(22,23)24/h3,5,7,9-10,14H,4,6,8,11-12H2,1-2H3/t14-/m0/s1