2-(2-phenylprop-2-enylsulfanyl)ethanoic acid; sodium

Systemtic Name: 2-(2-phenylprop-2-enylsulfanyl)ethanoic acid; sodium Openeye Name: 2-(2-phenylallylsulfanyl)acetic acid; sodium CAS Name: 2-(2-phenylprop-2-enylthio)acetic acid; sodium IUPAC Name: 2-(2-phenylprop-2-enylsulfanyl)acetic acid; sodium Traditional Name: 2-(2-phenylallylthio)acetic acid; sodium Formula: C11H12NaO2S MolecularWeight: 231.26655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CSCC(=O)O)C1=CC=CC=C1.[Na]

Isomeric SMILES

C=C(CSCC(=O)O)C1=CC=CC=C1.[Na]

InChI

InChI=1S/C11H12O2S.Na/c1-9(7-14-8-11(12)13)10-5-3-2-4-6-10;/h2-6H,1,7-8H2,(H,12,13);