methyl (3S)-4-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S)-4-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Openeye Name: methyl (3S)-4-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate CAS Name: (3S)-4-[4-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S)-4-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-4-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid methyl ester Formula: C13H14F3NO2 MolecularWeight: 273.25097

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CNCC1C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

COC(=O)[C@@H]1CNCC1C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H14F3NO2/c1-19-12(18)11-7-17-6-10(11)8-2-4-9(5-3-8)13(14,15)16/h2-5,10-11,17H,6-7H2,1H3/t10?,11-/m1/s1