2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]-4-(methylthio)butyric acid Formula: C11H19NO4S MolecularWeight: 261.33786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(CCSC)C(=O)O

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(CCSC)C(=O)O

InChI

InChI=1S/C11H19NO4S/c1-4-16-10(13)7-8(2)12-9(11(14)15)5-6-17-3/h7,9,12H,4-6H2,1-3H3,(H,14,15)/b8-7+