4-chloranyl-3-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]benzoic acid Openeye Name: 4-chloro-3-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]benzoic acid CAS Name: 4-chloro-3-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]benzoic acid IUPAC Name: 4-chloro-3-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]benzoic acid Traditional Name: 4-chloro-3-(homoveratrylsulfamoyl)benzoic acid Formula: C17H18ClNO6S MolecularWeight: 399.84592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClNO6S/c1-24-14-6-3-11(9-15(14)25-2)7-8-19-26(22,23)16-10-12(17(20)21)4-5-13(16)18/h3-6,9-10,19H,7-8H2,1-2H3,(H,20,21)