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

Systemtic Name: 4-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: 4-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: 4-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: 4-[6-(3,4,5-trimethoxyphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: 4-[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=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3

InChI

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