3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-sulfamoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[(5-chloro-2-methoxy-phenyl)methyl-methyl-sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[(5-chloro-2-methoxyphenyl)methyl-methylsulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[(5-chloro-2-methoxyphenyl)methyl-methylsulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[(5-chloro-2-methoxy-benzyl)-methyl-sulfamoyl]-4-methoxy-benzoic acid Formula: C17H18ClNO6S MolecularWeight: 399.84592

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Cl)OC)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Cl)OC)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC

InChI

InChI=1S/C17H18ClNO6S/c1-19(10-12-8-13(18)5-7-14(12)24-2)26(22,23)16-9-11(17(20)21)4-6-15(16)25-3/h4-9H,10H2,1-3H3,(H,20,21)