methyl 4-chloranyl-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoate Openeye Name: methyl 4-chloro-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoate CAS Name: 4-chloro-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoate Traditional Name: 4-chloro-3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoic acid methyl ester Formula: C16H17ClN2O6S2 MolecularWeight: 432.89898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H17ClN2O6S2/c1-25-16(20)12-4-7-14(17)15(10-12)27(23,24)19-9-8-11-2-5-13(6-3-11)26(18,21)22/h2-7,10,19H,8-9H2,1H3,(H2,18,21,22)