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

Systemtic Name: (3S)-1-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate CAS Name: (3S)-1-[4-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-1-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Formula: C12H11F3NO2- MolecularWeight: 258.21645

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C(=O)[O-])C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CN(C[C@H]1C(=O)[O-])C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C12H12F3NO2/c13-12(14,15)9-1-3-10(4-2-9)16-6-5-8(7-16)11(17)18/h1-4,8H,5-7H2,(H,17,18)/p-1/t8-/m0/s1