4-(4-chloranyl-3-sulfamoyl-phenyl)-3-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chloranyl-3-sulfamoyl-phenyl)-3-oxidanylidene-butanoic acid Openeye Name: 4-(4-chloro-3-sulfamoyl-phenyl)-3-oxo-butanoic acid CAS Name: 4-(4-chloro-3-sulfamoylphenyl)-3-oxobutanoic acid IUPAC Name: 4-(4-chloro-3-sulfamoylphenyl)-3-oxobutanoic acid Traditional Name: 4-(4-chloro-3-sulfamoyl-phenyl)-3-keto-butyric acid Formula: C10H10ClNO5S MolecularWeight: 291.7081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(=O)CC(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1CC(=O)CC(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C10H10ClNO5S/c11-8-2-1-6(3-7(13)5-10(14)15)4-9(8)18(12,16)17/h1-2,4H,3,5H2,(H,14,15)(H2,12,16,17)