(3R)-1-[2-(3-methoxy-4-phenethyloxy-phenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3R)-1-[2-(3-methoxy-4-phenethyloxy-phenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3R)-1-[2-(3-methoxy-4-phenethyloxy-phenyl)ethyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3R)-1-[2-(3-methoxy-4-phenethyloxyphenyl)ethyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3R)-1-[2-(3-methoxy-4-phenethyloxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: (3R)-5-keto-1-[2-(3-methoxy-4-phenethyloxy-phenyl)ethyl]pyrrolidine-3-carboxylic acid Formula: C22H25NO5 MolecularWeight: 383.4376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCN2CC(CC2=O)C(=O)O)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CCN2C[C@@H](CC2=O)C(=O)O)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO5/c1-27-20-13-17(9-11-23-15-18(22(25)26)14-21(23)24)7-8-19(20)28-12-10-16-5-3-2-4-6-16/h2-8,13,18H,9-12,14-15H2,1H3,(H,25,26)/t18-/m1/s1