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

Systemtic Name: 4-bromanyl-3-[(2-methoxy-5-methyl-phenyl)methyl-methyl-sulfamoyl]benzoic acid Openeye Name: 4-bromo-3-[(2-methoxy-5-methyl-phenyl)methyl-methyl-sulfamoyl]benzoic acid CAS Name: 4-bromo-3-[(2-methoxy-5-methylphenyl)methyl-methylsulfamoyl]benzoic acid IUPAC Name: 4-bromo-3-[(2-methoxy-5-methylphenyl)methyl-methylsulfamoyl]benzoic acid Traditional Name: 4-bromo-3-[(2-methoxy-5-methyl-benzyl)-methyl-sulfamoyl]benzoic acid Formula: C17H18BrNO5S MolecularWeight: 428.29752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrNO5S/c1-11-4-7-15(24-3)13(8-11)10-19(2)25(22,23)16-9-12(17(20)21)5-6-14(16)18/h4-9H,10H2,1-3H3,(H,20,21)