4-[[(3-methoxy-4-oxidanyl-phenyl)-[(4-sulfamoylphenyl)amino]methyl]amino]benzenesulfonamide

Systemtic Name: 4-[[(3-methoxy-4-oxidanyl-phenyl)-[(4-sulfamoylphenyl)amino]methyl]amino]benzenesulfonamide Openeye Name: 4-[[(4-hydroxy-3-methoxy-phenyl)-(4-sulfamoylanilino)methyl]amino]benzenesulfonamide CAS Name: 4-[[(4-hydroxy-3-methoxyphenyl)-(4-sulfamoylanilino)methyl]amino]benzenesulfonamide IUPAC Name: 4-[[(4-hydroxy-3-methoxyphenyl)-(4-sulfamoylanilino)methyl]amino]benzenesulfonamide Traditional Name: 4-[[(4-hydroxy-3-methoxy-phenyl)-(4-sulfamoylanilino)methyl]amino]benzenesulfonamide Formula: C20H22N4O6S2 MolecularWeight: 478.54188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(NC2=CC=C(C=C2)S(=O)(=O)N)NC3=CC=C(C=C3)S(=O)(=O)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(NC2=CC=C(C=C2)S(=O)(=O)N)NC3=CC=C(C=C3)S(=O)(=O)N)O

InChI

InChI=1S/C20H22N4O6S2/c1-30-19-12-13(2-11-18(19)25)20(23-14-3-7-16(8-4-14)31(21,26)27)24-15-5-9-17(10-6-15)32(22,28)29/h2-12,20,23-25H,1H3,(H2,21,26,27)(H2,22,28,29)