(3R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methylsulfonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methylsulfonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methylsulfonylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methylsulfonylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methylsulfonylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3R)-1-homoveratryl-5-keto-N-(4-mesylphenyl)pyrrolidine-3-carboxamide Formula: C22H26N2O6S MolecularWeight: 446.51664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C[C@@H](CC2=O)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C22H26N2O6S/c1-29-19-9-4-15(12-20(19)30-2)10-11-24-14-16(13-21(24)25)22(26)23-17-5-7-18(8-6-17)31(3,27)28/h4-9,12,16H,10-11,13-14H2,1-3H3,(H,23,26)/t16-/m1/s1