3-chloranyl-4-ethyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid

Systemtic Name: 3-chloranyl-4-ethyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid Openeye Name: 3-chloro-4-ethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid CAS Name: 3-chloro-4-ethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid IUPAC Name: 3-chloro-4-ethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid Traditional Name: 3-chloro-4-ethyl-2-keto-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid Formula: C14H13ClF3NO3 MolecularWeight: 335.70613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C(=O)C1(C(=O)O)Cl)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCC1CN(C(=O)C1(C(=O)O)Cl)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H13ClF3NO3/c1-2-8-7-19(11(20)13(8,15)12(21)22)10-5-3-4-9(6-10)14(16,17)18/h3-6,8H,2,7H2,1H3,(H,21,22)