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

Systemtic Name: 4-[6-[3-(dimethylamino)-4-methyl-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: 4-[6-[3-(dimethylamino)-4-methyl-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: 4-[6-[3-(dimethylamino)-4-methylphenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: 4-[6-[3-(dimethylamino)-4-methylphenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: 4-[6-[3-(dimethylamino)-4-methyl-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)N(C)C

InChI

InChI=1S/C22H22N2O4S/c1-14-4-5-16(10-20(14)24(2)3)19-12-22-21(27-13-28-22)11-18(19)15-6-8-17(9-7-15)29(23,25)26/h4-12H,13H2,1-3H3,(H2,23,25,26)