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

Systemtic Name: N-[4-azanyl-3-(5-methoxy-1,3-benzodioxol-4-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[4-amino-3-(5-methoxy-1,3-benzodioxol-4-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[4-amino-3-(5-methoxy-1,3-benzodioxol-4-yl)phenyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[4-amino-3-(5-methoxy-1,3-benzodioxol-4-yl)phenyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[4-amino-3-(5-methoxy-1,3-benzodioxol-4-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C22H22N2O7S MolecularWeight: 458.48428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N)C3=C(C=CC4=C3OCO4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N)C3=C(C=CC4=C3OCO4)OC)OC

InChI

InChI=1S/C22H22N2O7S/c1-27-17-7-5-14(11-20(17)29-3)32(25,26)24-13-4-6-16(23)15(10-13)21-18(28-2)8-9-19-22(21)31-12-30-19/h4-11,24H,12,23H2,1-3H3