4-[6-(3,5-dimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name: 4-[6-(3,5-dimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: 4-[6-(3,5-dimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: 4-[6-(3,5-dimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: 4-[6-(3,5-dimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: 4-[6-(3,5-dimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C21H19NO6S MolecularWeight: 413.44366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)OC

InChI

InChI=1S/C21H19NO6S/c1-25-15-7-14(8-16(9-15)26-2)19-11-21-20(27-12-28-21)10-18(19)13-3-5-17(6-4-13)29(22,23)24/h3-11H,12H2,1-2H3,(H2,22,23,24)