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

Systemtic Name: N-[6-(3-methoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: N-[6-(3-methoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: N-[6-(3-methoxy-4-methylphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: N-[6-(3-methoxy-4-methylphenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: N-[6-(3-methoxy-4-methyl-phenyl)-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC3=C(C=C2NS(=O)(=O)C4=CC=CC=C4)OCO3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC3=C(C=C2NS(=O)(=O)C4=CC=CC=C4)OCO3)OC

InChI

InChI=1S/C21H19NO5S/c1-14-8-9-15(10-19(14)25-2)17-11-20-21(27-13-26-20)12-18(17)22-28(23,24)16-6-4-3-5-7-16/h3-12,22H,13H2,1-2H3