2-methyl-4-oxidanylidene-2-phenyl-4-(2-sulfamoylethylamino)butanoic acid

Systemtic Name: 2-methyl-4-oxidanylidene-2-phenyl-4-(2-sulfamoylethylamino)butanoic acid Openeye Name: 2-methyl-4-oxo-2-phenyl-4-(2-sulfamoylethylamino)butanoic acid CAS Name: 2-methyl-4-oxo-2-phenyl-4-(2-sulfamoylethylamino)butanoic acid IUPAC Name: 2-methyl-4-oxo-2-phenyl-4-(2-sulfamoylethylamino)butanoic acid Traditional Name: 4-keto-2-methyl-2-phenyl-4-(2-sulfamoylethylamino)butyric acid Formula: C13H18N2O5S MolecularWeight: 314.35742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCCS(=O)(=O)N)(C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CC(=O)NCCS(=O)(=O)N)(C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-13(12(17)18,10-5-3-2-4-6-10)9-11(16)15-7-8-21(14,19)20/h2-6H,7-9H2,1H3,(H,15,16)(H,17,18)(H2,14,19,20)