methyl (Z)-4-(2-methylsulfanylethylamino)-1-oxidanyl-3,4-bis(oxidanylidene)-1-phenyl-but-1-ene-2-sulfonate

Systemtic Name: methyl (Z)-4-(2-methylsulfanylethylamino)-1-oxidanyl-3,4-bis(oxidanylidene)-1-phenyl-but-1-ene-2-sulfonate Openeye Name: methyl (Z)-1-hydroxy-4-(2-methylsulfanylethylamino)-3,4-dioxo-1-phenyl-but-1-ene-2-sulfonate CAS Name: (Z)-1-hydroxy-4-[2-(methylthio)ethylamino]-3,4-dioxo-1-phenyl-1-butene-2-sulfonic acid methyl ester IUPAC Name: methyl (Z)-1-hydroxy-4-(2-methylsulfanylethylamino)-3,4-dioxo-1-phenylbut-1-ene-2-sulfonate Traditional Name: (Z)-1-hydroxy-3,4-diketo-4-[2-(methylthio)ethylamino]-1-phenyl-but-1-ene-2-sulfonic acid methyl ester Formula: C14H17NO6S2 MolecularWeight: 359.41788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C(=C(C1=CC=CC=C1)O)C(=O)C(=O)NCCSC

Isomeric SMILES

COS(=O)(=O)/C(=C(/C1=CC=CC=C1)\O)/C(=O)C(=O)NCCSC

InChI

InChI=1S/C14H17NO6S2/c1-21-23(19,20)13(11(16)10-6-4-3-5-7-10)12(17)14(18)15-8-9-22-2/h3-7,16H,8-9H2,1-2H3,(H,15,18)/b13-11-