(2R,4S)-1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-methoxy-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-methoxy-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-methoxy-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-methoxy-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-methoxypyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-methoxy-pyrrolidine-2-carboxylate Formula: C12H11ClF3N2O3- MolecularWeight: 323.67555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)[O-]

Isomeric SMILES

CO[C@H]1C[C@@H](N(C1)C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)[O-]

InChI

InChI=1S/C12H12ClF3N2O3/c1-21-7-3-9(11(19)20)18(5-7)10-8(13)2-6(4-17-10)12(14,15)16/h2,4,7,9H,3,5H2,1H3,(H,19,20)/p-1/t7-,9+/m0/s1