[(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] (E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] (E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] (E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(2-chloro-6-fluorophenyl)-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-(2-chloro-6-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(2-chloro-6-fluoro-phenyl)acrylic acid [(1R)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C22H21ClFNO3 MolecularWeight: 401.858443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)OC(=O)/C=C/C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H21ClFNO3/c23-18-10-7-11-19(24)17(18)12-13-20(26)28-21(16-8-3-1-4-9-16)22(27)25-14-5-2-6-15-25/h1,3-4,7-13,21H,2,5-6,14-15H2/b13-12+/t21-/m1/s1