4-[6-[3,4-bis(dimethylamino)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide

Systemtic Name: 4-[6-[3,4-bis(dimethylamino)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Openeye Name: 4-[6-[3,4-bis(dimethylamino)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide CAS Name: 4-[6-[3,4-bis(dimethylamino)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide IUPAC Name: 4-[6-[3,4-bis(dimethylamino)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Traditional Name: 4-[6-[3,4-bis(dimethylamino)phenyl]-1,3-benzodioxol-5-yl]benzenesulfonamide Formula: C23H25N3O4S MolecularWeight: 439.5273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)N(C)C

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C2=CC3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N)OCO3)N(C)C

InChI

InChI=1S/C23H25N3O4S/c1-25(2)20-10-7-16(11-21(20)26(3)4)19-13-23-22(29-14-30-23)12-18(19)15-5-8-17(9-6-15)31(24,27)28/h5-13H,14H2,1-4H3,(H2,24,27,28)