3-[(4-ethenylphenyl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(4-ethenylphenyl)methylsulfanyl]propanoic acid Openeye Name: 3-[(4-vinylphenyl)methylsulfanyl]propanoic acid CAS Name: 3-[(4-ethenylphenyl)methylthio]propanoic acid IUPAC Name: 3-[(4-ethenylphenyl)methylsulfanyl]propanoic acid Traditional Name: 3-[(4-vinylbenzyl)thio]propionic acid Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CSCCC(=O)O

Isomeric SMILES

C=CC1=CC=C(C=C1)CSCCC(=O)O

InChI

InChI=1S/C12H14O2S/c1-2-10-3-5-11(6-4-10)9-15-8-7-12(13)14/h2-6H,1,7-9H2,(H,13,14)