methyl 4-[4-chloranyl-3-(methylsulfamoyl)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-chloranyl-3-(methylsulfamoyl)phenyl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-chloro-3-(methylsulfamoyl)phenyl]-4-oxo-butanoate CAS Name: 4-[4-chloro-3-(methylsulfamoyl)phenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-chloro-3-(methylsulfamoyl)phenyl]-4-oxobutanoate Traditional Name: 4-[4-chloro-3-(methylsulfamoyl)phenyl]-4-keto-butyric acid methyl ester Formula: C12H14ClNO5S MolecularWeight: 319.76126

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)CCC(=O)OC)Cl

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)CCC(=O)OC)Cl

InChI

InChI=1S/C12H14ClNO5S/c1-14-20(17,18)11-7-8(3-4-9(11)13)10(15)5-6-12(16)19-2/h3-4,7,14H,5-6H2,1-2H3