2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(3,4-dimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(3,4-dimethoxyphenyl)methyl]ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(3,4-dimethoxyphenyl)methyl]acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-veratryl-acetamide Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C)OC

InChI

InChI=1S/C19H22N2O7S/c1-25-15-6-4-13(8-17(15)26-2)10-20-19(22)11-21(29(3,23)24)14-5-7-16-18(9-14)28-12-27-16/h4-9H,10-12H2,1-3H3,(H,20,22)