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

Systemtic Name: N-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: N-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: N-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: N-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: N-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C22H21NO7S MolecularWeight: 443.46964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC3=C(C=C2NS(=O)(=O)C4=CC=CC=C4)OCO3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC3=C(C=C2NS(=O)(=O)C4=CC=CC=C4)OCO3

InChI

InChI=1S/C22H21NO7S/c1-26-20-9-14(10-21(27-2)22(20)28-3)16-11-18-19(30-13-29-18)12-17(16)23-31(24,25)15-7-5-4-6-8-15/h4-12,23H,13H2,1-3H3