methyl (2E)-2-cyano-4-sulfanyl-penta-2,4-dienoate

Systemtic Name: methyl (2E)-2-cyano-4-sulfanyl-penta-2,4-dienoate Openeye Name: methyl (2E)-2-cyano-4-sulfanyl-penta-2,4-dienoate CAS Name: (2E)-2-cyano-4-mercaptopenta-2,4-dienoic acid methyl ester IUPAC Name: methyl (2E)-2-cyano-4-sulfanylpenta-2,4-dienoate Traditional Name: (2E)-2-cyano-4-mercapto-penta-2,4-dienoic acid methyl ester Formula: C7H7NO2S MolecularWeight: 169.20098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC(=C)S)C#N

Isomeric SMILES

COC(=O)/C(=C/C(=C)S)/C#N

InChI

InChI=1S/C7H7NO2S/c1-5(11)3-6(4-8)7(9)10-2/h3,11H,1H2,2H3/b6-3+