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

Systemtic Name: 3-[4-[(2-chloranyl-4,5-dimethoxy-phenyl)sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(2-chloro-4,5-dimethoxy-phenyl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(2-chloro-4,5-dimethoxyphenyl)sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(2-chloro-4,5-dimethoxyphenyl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(2-chloro-4,5-dimethoxy-phenyl)sulfamoyl]phenyl]propionic acid Formula: C17H18ClNO6S MolecularWeight: 399.84592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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