N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[2-methyl-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: 2-(2-methyl-4-pyrrolidinosulfonyl-phenoxy)-N-veratryl-acetamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O6S/c1-16-12-18(31(26,27)24-10-4-5-11-24)7-9-19(16)30-15-22(25)23-14-17-6-8-20(28-2)21(13-17)29-3/h6-9,12-13H,4-5,10-11,14-15H2,1-3H3,(H,23,25)