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

Systemtic Name: 4-bromanyl-3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-sulfamoyl]benzoic acid Openeye Name: 4-bromo-3-[(5-chloro-2-methoxy-phenyl)methyl-methyl-sulfamoyl]benzoic acid CAS Name: 4-bromo-3-[(5-chloro-2-methoxyphenyl)methyl-methylsulfamoyl]benzoic acid IUPAC Name: 4-bromo-3-[(5-chloro-2-methoxyphenyl)methyl-methylsulfamoyl]benzoic acid Traditional Name: 4-bromo-3-[(5-chloro-2-methoxy-benzyl)-methyl-sulfamoyl]benzoic acid Formula: C16H15BrClNO5S MolecularWeight: 448.716

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrClNO5S/c1-19(9-11-7-12(18)4-6-14(11)24-2)25(22,23)15-8-10(16(20)21)3-5-13(15)17/h3-8H,9H2,1-2H3,(H,20,21)