dimethyl (E)-2-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)amino]but-2-enedioate

Systemtic Name: dimethyl (E)-2-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)amino]but-2-enedioate Openeye Name: dimethyl (E)-2-[(1-methoxycarbonyl-3-methylsulfanyl-propyl)amino]but-2-enedioate CAS Name: (E)-2-[[1-methoxy-4-(methylthio)-1-oxobutan-2-yl]amino]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-[(1-methoxy-4-methylsulfanyl-1-oxobutan-2-yl)amino]but-2-enedioate Traditional Name: (E)-2-[[1-carbomethoxy-3-(methylthio)propyl]amino]but-2-enedioic acid dimethyl ester Formula: C12H19NO6S MolecularWeight: 305.34736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)NC(CCSC)C(=O)OC

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/NC(CCSC)C(=O)OC

InChI

InChI=1S/C12H19NO6S/c1-17-10(14)7-9(12(16)19-3)13-8(5-6-20-4)11(15)18-2/h7-8,13H,5-6H2,1-4H3/b9-7+