(E)-3-octylsulfanylbut-2-enoate

Systemtic Name: (E)-3-octylsulfanylbut-2-enoate Openeye Name: (E)-3-octylsulfanylbut-2-enoate CAS Name: (E)-3-(octylthio)-2-butenoate IUPAC Name: (E)-3-octylsulfanylbut-2-enoate Traditional Name: (E)-3-(octylthio)but-2-enoate Formula: C12H21O2S- MolecularWeight: 229.35894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=CC(=O)[O-])C

Isomeric SMILES

CCCCCCCCS/C(=C/C(=O)[O-])/C

InChI

InChI=1S/C12H22O2S/c1-3-4-5-6-7-8-9-15-11(2)10-12(13)14/h10H,3-9H2,1-2H3,(H,13,14)/p-1/b11-10+