N-[6-(3,5-dimethoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name: N-[6-(3,5-dimethoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: N-[6-(3,5-dimethoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: N-[6-(3,5-dimethoxy-4-methylphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: N-[6-(3,5-dimethoxy-4-methylphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: N-[6-(3,5-dimethoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C2=CC3=C(C=C2NS(=O)(=O)C4=CC=CC=C4)OCO3)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C2=CC3=C(C=C2NS(=O)(=O)C4=CC=CC=C4)OCO3)OC

InChI

InChI=1S/C22H21NO6S/c1-14-19(26-2)9-15(10-20(14)27-3)17-11-21-22(29-13-28-21)12-18(17)23-30(24,25)16-7-5-4-6-8-16/h4-12,23H,13H2,1-3H3