4-[4-chloranyl-3-(cyclododecylsulfamoyl)phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-chloranyl-3-(cyclododecylsulfamoyl)phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-chloro-3-(cyclododecylsulfamoyl)phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-chloro-3-(cyclododecylsulfamoyl)phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-chloro-3-(cyclododecylsulfamoyl)phenyl]-4-oxobutanoic acid Traditional Name: 4-[4-chloro-3-(cyclododecylsulfamoyl)phenyl]-4-keto-butyric acid Formula: C22H32ClNO5S MolecularWeight: 458.01118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)CCC(=O)O)Cl

Isomeric SMILES

C1CCCCCC(CCCCC1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)CCC(=O)O)Cl

InChI

InChI=1S/C22H32ClNO5S/c23-19-13-12-17(20(25)14-15-22(26)27)16-21(19)30(28,29)24-18-10-8-6-4-2-1-3-5-7-9-11-18/h12-13,16,18,24H,1-11,14-15H2,(H,26,27)