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

Systemtic Name: 4-[6-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: 4-[6-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: 4-[6-[3-(dimethylamino)-4-methoxyphenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: 4-[6-[3-(dimethylamino)-4-methoxyphenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: 4-[6-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O5S/c1-24(2)19-10-15(6-9-20(19)27-3)18-12-22-21(28-13-29-22)11-17(18)14-4-7-16(8-5-14)30(23,25)26/h4-12H,13H2,1-3H3,(H2,23,25,26)