4-chloranyl-3-[2-cyanoethyl(methyl)sulfamoyl]benzoate

Systemtic Name: 4-chloranyl-3-[2-cyanoethyl(methyl)sulfamoyl]benzoate Openeye Name: 4-chloro-3-[2-cyanoethyl(methyl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[2-cyanoethyl(methyl)sulfamoyl]benzoate IUPAC Name: 4-chloro-3-[2-cyanoethyl(methyl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[2-cyanoethyl(methyl)sulfamoyl]benzoate Formula: C11H10ClN2O4S- MolecularWeight: 301.7261

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)S(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])Cl

Isomeric SMILES

CN(CCC#N)S(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])Cl

InChI

InChI=1S/C11H11ClN2O4S/c1-14(6-2-5-13)19(17,18)10-7-8(11(15)16)3-4-9(10)12/h3-4,7H,2,6H2,1H3,(H,15,16)/p-1