N-[2-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name: N-[2-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: N-[2-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: N-[2-[3-(dimethylamino)-4-methoxyphenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: N-[2-[3-(dimethylamino)-4-methoxyphenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: N-[2-[3-(dimethylamino)-4-methoxy-phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC(=C1)C2OC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

CN(C)C1=C(C=CC(=C1)C2OC3=C(O2)C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H22N2O5S/c1-24(2)18-13-15(9-11-19(18)27-3)22-28-20-12-10-16(14-21(20)29-22)23-30(25,26)17-7-5-4-6-8-17/h4-14,22-23H,1-3H3