3-[2-(3-chloranylphenoxy)ethyl-methyl-sulfamoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[2-(3-chloranylphenoxy)ethyl-methyl-sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[2-(3-chlorophenoxy)ethyl-methyl-sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[2-(3-chlorophenoxy)ethyl-methylsulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[2-(3-chlorophenoxy)ethyl-methylsulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[2-(3-chlorophenoxy)ethyl-methyl-sulfamoyl]-4-methoxy-benzoic acid Formula: C17H18ClNO6S MolecularWeight: 399.84592

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC(=CC=C1)Cl)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

Isomeric SMILES

CN(CCOC1=CC(=CC=C1)Cl)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

InChI

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