3-[(E)-3-phenylprop-2-enyl]sulfanylpropanoate

Systemtic Name: 3-[(E)-3-phenylprop-2-enyl]sulfanylpropanoate Openeye Name: 3-[(E)-cinnamyl]sulfanylpropanoate CAS Name: 3-[[(E)-3-phenylprop-2-enyl]thio]propanoate IUPAC Name: 3-[(E)-3-phenylprop-2-enyl]sulfanylpropanoate Traditional Name: 3-[[(E)-cinnamyl]thio]propionate Formula: C12H13O2S- MolecularWeight: 221.29542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSCCC(=O)[O-]

InChI

InChI=1S/C12H14O2S/c13-12(14)8-10-15-9-4-7-11-5-2-1-3-6-11/h1-7H,8-10H2,(H,13,14)/p-1/b7-4+