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

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)sulfonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)sulfonylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(3-fluoro-4-methoxyphenyl)sulfonylamino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)sulfonylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(3-fluoro-4-methoxy-phenyl)sulfonylamino]-4-(methylthio)butyric acid Formula: C12H16FNO5S2 MolecularWeight: 337.387543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)O)F

InChI

InChI=1S/C12H16FNO5S2/c1-19-11-4-3-8(7-9(11)13)21(17,18)14-10(12(15)16)5-6-20-2/h3-4,7,10,14H,5-6H2,1-2H3,(H,15,16)