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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)OC

InChI

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