2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(3-methylbutyl)amino]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(3-methylbutyl)amino]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(isopentyl)amino]-N-(o-tolyl)acetamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(3-methylbutyl)amino]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(3-methylbutyl)amino]-N-(2-methylphenyl)acetamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(isoamyl)amino]-N-(o-tolyl)acetamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CN(CCC(C)C)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CN(CCC(C)C)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C22H28N2O5S/c1-16(2)10-11-24(15-22(25)23-19-7-5-4-6-17(19)3)30(26,27)18-8-9-20-21(14-18)29-13-12-28-20/h4-9,14,16H,10-13,15H2,1-3H3,(H,23,25)