2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(esyl)amino]-N-(3-o-phenetylpropyl)acetamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCCNC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)CC

Isomeric SMILES

CCOC1=CC=CC=C1CCCNC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)CC

InChI

InChI=1S/C22H28N2O6S/c1-3-28-19-10-6-5-8-17(19)9-7-13-23-22(25)15-24(31(26,27)4-2)18-11-12-20-21(14-18)30-16-29-20/h5-6,8,10-12,14H,3-4,7,9,13,15-16H2,1-2H3,(H,23,25)