[(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 2-chloro-4,5-difluoro-benzoate CAS Name: 2-chloro-4,5-difluorobenzoic acid [(1R)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] 2-chloro-4,5-difluorobenzoate Traditional Name: 2-chloro-4,5-difluoro-benzoic acid [(1R)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C20H18ClF2NO3 MolecularWeight: 393.811626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3Cl)F)F

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClF2NO3/c21-15-12-17(23)16(22)11-14(15)20(26)27-18(13-7-3-1-4-8-13)19(25)24-9-5-2-6-10-24/h1,3-4,7-8,11-12,18H,2,5-6,9-10H2/t18-/m1/s1