methyl 5-bromanyl-2-[(4-sulfamoylphenyl)sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(4-sulfamoylphenyl)sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[(4-sulfamoylphenyl)sulfamoyl]benzoate CAS Name: 5-bromo-2-[(4-sulfamoylphenyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(4-sulfamoylphenyl)sulfamoyl]benzoate Traditional Name: 5-bromo-2-[(4-sulfamoylphenyl)sulfamoyl]benzoic acid methyl ester Formula: C14H13BrN2O6S2 MolecularWeight: 449.29682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C14H13BrN2O6S2/c1-23-14(18)12-8-9(15)2-7-13(12)25(21,22)17-10-3-5-11(6-4-10)24(16,19)20/h2-8,17H,1H3,(H2,16,19,20)