ethyl (E)-2-methyl-3-sulfanyl-but-2-enoate

Systemtic Name: ethyl (E)-2-methyl-3-sulfanyl-but-2-enoate Openeye Name: ethyl (E)-2-methyl-3-sulfanyl-but-2-enoate CAS Name: (E)-3-mercapto-2-methyl-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-methyl-3-sulfanylbut-2-enoate Traditional Name: (E)-3-mercapto-2-methyl-but-2-enoic acid ethyl ester Formula: C7H12O2S MolecularWeight: 160.23398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)S)C

Isomeric SMILES

CCOC(=O)/C(=C(\C)/S)/C

InChI

InChI=1S/C7H12O2S/c1-4-9-7(8)5(2)6(3)10/h10H,4H2,1-3H3/b6-5+