(3S)-1-[4-(trifluoromethyl)phenyl]carbonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-[4-(trifluoromethyl)phenyl]carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-[4-(trifluoromethyl)benzoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-[4-(trifluoromethyl)benzoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[4-(trifluoromethyl)benzoyl]nipecotate Formula: C14H13F3NO3- MolecularWeight: 300.25313

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC=C(C=C2)C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C14H14F3NO3/c15-14(16,17)11-5-3-9(4-6-11)12(19)18-7-1-2-10(8-18)13(20)21/h3-6,10H,1-2,7-8H2,(H,20,21)/p-1/t10-/m0/s1