4-chloranyl-3-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 4-chloro-3-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)sulfamoyl]benzoic acid CAS Name: 4-chloro-3-[(4,5-dimethoxy-2-methoxycarbonylphenyl)sulfamoyl]benzoic acid IUPAC Name: 4-chloro-3-[(4,5-dimethoxy-2-methoxycarbonylphenyl)sulfamoyl]benzoic acid Traditional Name: 3-[(2-carbomethoxy-4,5-dimethoxy-phenyl)sulfamoyl]-4-chloro-benzoic acid Formula: C17H16ClNO8S MolecularWeight: 429.82884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl)OC

InChI

InChI=1S/C17H16ClNO8S/c1-25-13-7-10(17(22)27-3)12(8-14(13)26-2)19-28(23,24)15-6-9(16(20)21)4-5-11(15)18/h4-8,19H,1-3H3,(H,20,21)