3-[[2-(1-benzothiophen-2-ylsulfonylamino)phenyl]sulfamoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[[2-(1-benzothiophen-2-ylsulfonylamino)phenyl]sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[[2-(benzothiophen-2-ylsulfonylamino)phenyl]sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[[2-(1-benzothiophen-2-ylsulfonylamino)phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[[2-(1-benzothiophen-2-ylsulfonylamino)phenyl]sulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[[2-(benzothiophen-2-ylsulfonylamino)phenyl]sulfamoyl]-4-methoxy-benzoic acid Formula: C22H18N2O7S3 MolecularWeight: 518.58252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2NS(=O)(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2NS(=O)(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C22H18N2O7S3/c1-31-18-11-10-15(22(25)26)12-20(18)33(27,28)23-16-7-3-4-8-17(16)24-34(29,30)21-13-14-6-2-5-9-19(14)32-21/h2-13,23-24H,1H3,(H,25,26)