[(E)-2,2-dimethyl-4-phenylsulfanyl-but-3-enyl] ethanoate

Systemtic Name: [(E)-2,2-dimethyl-4-phenylsulfanyl-but-3-enyl] ethanoate Openeye Name: [(E)-2,2-dimethyl-4-phenylsulfanyl-but-3-enyl] acetate CAS Name: acetic acid [(E)-2,2-dimethyl-4-(phenylthio)but-3-enyl] ester IUPAC Name: [(E)-2,2-dimethyl-4-phenylsulfanylbut-3-enyl] acetate Traditional Name: acetic acid [(E)-2,2-dimethyl-4-(phenylthio)but-3-enyl] ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(C)C=CSC1=CC=CC=C1

Isomeric SMILES

CC(=O)OCC(C)(C)/C=C/SC1=CC=CC=C1

InChI

InChI=1S/C14H18O2S/c1-12(15)16-11-14(2,3)9-10-17-13-7-5-4-6-8-13/h4-10H,11H2,1-3H3/b10-9+