prop-2-enyl 4-(ethanoylsulfanylmethyl)benzoate

Systemtic Name: prop-2-enyl 4-(ethanoylsulfanylmethyl)benzoate Openeye Name: allyl 4-(acetylsulfanylmethyl)benzoate CAS Name: 4-[(acetylthio)methyl]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(acetylsulfanylmethyl)benzoate Traditional Name: 4-[(acetylthio)methyl]benzoic acid allyl ester Formula: C13H14O3S MolecularWeight: 250.31346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CC=C(C=C1)C(=O)OCC=C

Isomeric SMILES

CC(=O)SCC1=CC=C(C=C1)C(=O)OCC=C

InChI

InChI=1S/C13H14O3S/c1-3-8-16-13(15)12-6-4-11(5-7-12)9-17-10(2)14/h3-7H,1,8-9H2,2H3