3-[(4-bromanyl-3-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoate

Systemtic Name: 3-[(4-bromanyl-3-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoate Openeye Name: 3-[(4-bromo-3-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoate CAS Name: 3-[(4-bromo-3-methylphenyl)sulfamoyl]-4,5-dimethylbenzoate IUPAC Name: 3-[(4-bromo-3-methylphenyl)sulfamoyl]-4,5-dimethylbenzoate Traditional Name: 3-[(4-bromo-3-methyl-phenyl)sulfamoyl]-4,5-dimethyl-benzoate Formula: C16H15BrNO4S- MolecularWeight: 397.2636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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