2-acetamido-3-(4-ethoxy-4-oxidanylidene-butan-2-yl)sulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-(4-ethoxy-4-oxidanylidene-butan-2-yl)sulfanyl-propanoic acid Openeye Name: 2-acetamido-3-(3-ethoxy-1-methyl-3-oxo-propyl)sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[(4-ethoxy-4-oxobutan-2-yl)thio]propanoic acid IUPAC Name: 2-acetamido-3-(4-ethoxy-4-oxobutan-2-yl)sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[(3-ethoxy-3-keto-1-methyl-propyl)thio]propionic acid Formula: C11H19NO5S MolecularWeight: 277.33726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)SCC(C(=O)O)NC(=O)C

Isomeric SMILES

CCOC(=O)CC(C)SCC(C(=O)O)NC(=O)C

InChI

InChI=1S/C11H19NO5S/c1-4-17-10(14)5-7(2)18-6-9(11(15)16)12-8(3)13/h7,9H,4-6H2,1-3H3,(H,12,13)(H,15,16)