[(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] (E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] (E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] (E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(trifluoromethyl)phenyl]-2-propenoic acid [(1R)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] (E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(trifluoromethyl)phenyl]acrylic acid [(1R)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C23H22F3NO3 MolecularWeight: 417.42089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)OC(=O)/C=C/C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H22F3NO3/c24-23(25,26)19-12-9-17(10-13-19)11-14-20(28)30-21(18-7-3-1-4-8-18)22(29)27-15-5-2-6-16-27/h1,3-4,7-14,21H,2,5-6,15-16H2/b14-11+/t21-/m1/s1