(E)-2-(methylperoxymethyl)-3-sulfanyl-prop-2-enenitrile

Systemtic Name: (E)-2-(methylperoxymethyl)-3-sulfanyl-prop-2-enenitrile Openeye Name: (E)-2-(methylperoxymethyl)-3-sulfanyl-prop-2-enenitrile CAS Name: (E)-3-mercapto-2-(methyldioxymethyl)-2-propenenitrile IUPAC Name: (E)-2-(methylperoxymethyl)-3-sulfanylprop-2-enenitrile Traditional Name: (E)-3-mercapto-2-(methylperoxymethyl)acrylonitrile Formula: C5H7NO2S MolecularWeight: 145.17958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COOCC(=CS)C#N

Isomeric SMILES

COOC/C(=C/S)/C#N

InChI

InChI=1S/C5H7NO2S/c1-7-8-3-5(2-6)4-9/h4,9H,3H2,1H3/b5-4+