1-[[4-chloranyl-3-(trifluoromethyl)phenyl]-pyridin-2-yl-methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[4-chloranyl-3-(trifluoromethyl)phenyl]-pyridin-2-yl-methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[4-chloro-3-(trifluoromethyl)phenyl]-(2-pyridyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-chloro-3-(trifluoromethyl)phenyl]-(2-pyridinyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[4-chloro-3-(trifluoromethyl)phenyl]-pyridin-2-ylmethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[4-chloro-3-(trifluoromethyl)phenyl]-(2-pyridyl)methyl]proline Formula: C18H16ClF3N2O2 MolecularWeight: 384.78005

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(C2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC=CC=N3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(C2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C18H16ClF3N2O2/c19-13-7-6-11(10-12(13)18(20,21)22)16(14-4-1-2-8-23-14)24-9-3-5-15(24)17(25)26/h1-2,4,6-8,10,15-16H,3,5,9H2,(H,25,26)