cyanomethyl 2,4-bis(chloranyl)-5-(2-methylpropylsulfamoyl)benzoate

Systemtic Name: cyanomethyl 2,4-bis(chloranyl)-5-(2-methylpropylsulfamoyl)benzoate Openeye Name: cyanomethyl 2,4-dichloro-5-(isobutylsulfamoyl)benzoate CAS Name: 2,4-dichloro-5-(2-methylpropylsulfamoyl)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2,4-dichloro-5-(2-methylpropylsulfamoyl)benzoate Traditional Name: 2,4-dichloro-5-(isobutylsulfamoyl)benzoic acid cyanomethyl ester Formula: C13H14Cl2N2O4S MolecularWeight: 365.23226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNS(=O)(=O)C1=C(C=C(C(=C1)C(=O)OCC#N)Cl)Cl

Isomeric SMILES

CC(C)CNS(=O)(=O)C1=C(C=C(C(=C1)C(=O)OCC#N)Cl)Cl

InChI

InChI=1S/C13H14Cl2N2O4S/c1-8(2)7-17-22(19,20)12-5-9(10(14)6-11(12)15)13(18)21-4-3-16/h5-6,8,17H,4,7H2,1-2H3