[3-[3,3-bis(methylsulfanyl)prop-2-enoyl]phenyl] ethanoate

Systemtic Name: [3-[3,3-bis(methylsulfanyl)prop-2-enoyl]phenyl] ethanoate Openeye Name: [3-[3,3-bis(methylsulfanyl)prop-2-enoyl]phenyl] acetate CAS Name: acetic acid [3-[3,3-bis(methylthio)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [3-[3,3-bis(methylsulfanyl)prop-2-enoyl]phenyl] acetate Traditional Name: acetic acid [3-[3,3-bis(methylthio)acryloyl]phenyl] ester Formula: C13H14O3S2 MolecularWeight: 282.37846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)C(=O)C=C(SC)SC

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)C(=O)C=C(SC)SC

InChI

InChI=1S/C13H14O3S2/c1-9(14)16-11-6-4-5-10(7-11)12(15)8-13(17-2)18-3/h4-8H,1-3H3