(2,3,6-trimethylphenyl) (3R)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (2,3,6-trimethylphenyl) (3R)-1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2,3,6-trimethylphenyl) (3R)-1-(3-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) (3R)-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-(3-methoxyphenyl)pyrrolidine-3-carboxylic acid (2,3,6-trimethylphenyl) ester Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)[C@@H]2CC(=O)N(C2)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C21H23NO4/c1-13-8-9-14(2)20(15(13)3)26-21(24)16-10-19(23)22(12-16)17-6-5-7-18(11-17)25-4/h5-9,11,16H,10,12H2,1-4H3/t16-/m1/s1