3-(5-ethoxycarbonylpyridin-2-yl)sulfanylpropanoate

Systemtic Name: 3-(5-ethoxycarbonylpyridin-2-yl)sulfanylpropanoate Openeye Name: 3-[(5-ethoxycarbonyl-2-pyridyl)sulfanyl]propanoate CAS Name: 3-[(5-ethoxycarbonyl-2-pyridinyl)thio]propanoate IUPAC Name: 3-(5-ethoxycarbonylpyridin-2-yl)sulfanylpropanoate Traditional Name: 3-[(5-carbethoxy-2-pyridyl)thio]propionate Formula: C11H12NO4S- MolecularWeight: 254.28228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)SCCC(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)SCCC(=O)[O-]

InChI

InChI=1S/C11H13NO4S/c1-2-16-11(15)8-3-4-9(12-7-8)17-6-5-10(13)14/h3-4,7H,2,5-6H2,1H3,(H,13,14)/p-1