N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[methylsulfonyl(phenethyl)amino]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[methylsulfonyl(phenethyl)amino]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[methylsulfonyl(phenethyl)amino]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[methylsulfonyl(phenethyl)amino]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[methylsulfonyl(phenethyl)amino]acetamide Traditional Name: N-homoveratryl-2-[mesyl(phenethyl)amino]acetamide Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C21H28N2O5S/c1-27-19-10-9-18(15-20(19)28-2)11-13-22-21(24)16-23(29(3,25)26)14-12-17-7-5-4-6-8-17/h4-10,15H,11-14,16H2,1-3H3,(H,22,24)