2-[(7-methoxy-1,3-benzodioxol-5-yl)-oxidanyl-methyl]-N-(2-methylphenyl)benzenesulfonamide

Systemtic Name: 2-[(7-methoxy-1,3-benzodioxol-5-yl)-oxidanyl-methyl]-N-(2-methylphenyl)benzenesulfonamide Openeye Name: 2-[hydroxy-(7-methoxy-1,3-benzodioxol-5-yl)methyl]-N-(o-tolyl)benzenesulfonamide CAS Name: 2-[hydroxy-(7-methoxy-1,3-benzodioxol-5-yl)methyl]-N-(2-methylphenyl)benzenesulfonamide IUPAC Name: 2-[hydroxy-(7-methoxy-1,3-benzodioxol-5-yl)methyl]-N-(2-methylphenyl)benzenesulfonamide Traditional Name: 2-[hydroxy-(7-methoxy-1,3-benzodioxol-5-yl)methyl]-N-(o-tolyl)benzenesulfonamide Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=CC=C2C(C3=CC4=C(C(=C3)OC)OCO4)O

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=CC=C2C(C3=CC4=C(C(=C3)OC)OCO4)O

InChI

InChI=1S/C22H21NO6S/c1-14-7-3-5-9-17(14)23-30(25,26)20-10-6-4-8-16(20)21(24)15-11-18(27-2)22-19(12-15)28-13-29-22/h3-12,21,23-24H,13H2,1-2H3