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

Systemtic Name: 3-[(4-bromanyl-2-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[(4-bromo-2-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[(4-bromo-2-methylphenyl)sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[(4-bromo-2-methylphenyl)sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[(4-bromo-2-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C16H16BrNO4S MolecularWeight: 398.27154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O

InChI

InChI=1S/C16H16BrNO4S/c1-9-6-12(16(19)20)8-15(11(9)3)23(21,22)18-14-5-4-13(17)7-10(14)2/h4-8,18H,1-3H3,(H,19,20)