4-[[4-chloranyl-3-(dimethylsulfamoyl)phenyl]carbonylamino]butanoate

Systemtic Name: 4-[[4-chloranyl-3-(dimethylsulfamoyl)phenyl]carbonylamino]butanoate Openeye Name: 4-[[4-chloro-3-(dimethylsulfamoyl)benzoyl]amino]butanoate CAS Name: 4-[[[4-chloro-3-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]butanoate IUPAC Name: 4-[[4-chloro-3-(dimethylsulfamoyl)benzoyl]amino]butanoate Traditional Name: 4-[[4-chloro-3-(dimethylsulfamoyl)benzoyl]amino]butyrate Formula: C13H16ClN2O5S- MolecularWeight: 347.79454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NCCCC(=O)[O-])Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NCCCC(=O)[O-])Cl

InChI

InChI=1S/C13H17ClN2O5S/c1-16(2)22(20,21)11-8-9(5-6-10(11)14)13(19)15-7-3-4-12(17)18/h5-6,8H,3-4,7H2,1-2H3,(H,15,19)(H,17,18)/p-1