2-[(4-methoxy-3-methyl-phenyl)sulfonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(4-methoxy-3-methyl-phenyl)sulfonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(4-methoxy-3-methyl-phenyl)sulfonylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-methoxy-3-methyl-phenyl)sulfonylamino]-4-(methylthio)butyric acid Formula: C13H19NO5S2 MolecularWeight: 333.42366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC(CCSC)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC(CCSC)C(=O)O)OC

InChI

InChI=1S/C13H19NO5S2/c1-9-8-10(4-5-12(9)19-2)21(17,18)14-11(13(15)16)6-7-20-3/h4-5,8,11,14H,6-7H2,1-3H3,(H,15,16)