(2-ethoxy-1-phenylsulfanyl-ethyl) ethanoate

Systemtic Name: (2-ethoxy-1-phenylsulfanyl-ethyl) ethanoate Openeye Name: (2-ethoxy-1-phenylsulfanyl-ethyl) acetate CAS Name: acetic acid [2-ethoxy-1-(phenylthio)ethyl] ester IUPAC Name: (2-ethoxy-1-phenylsulfanylethyl) acetate Traditional Name: acetic acid [2-ethoxy-1-(phenylthio)ethyl] ester Formula: C12H16O3S MolecularWeight: 240.31864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(OC(=O)C)SC1=CC=CC=C1

Isomeric SMILES

CCOCC(OC(=O)C)SC1=CC=CC=C1

InChI

InChI=1S/C12H16O3S/c1-3-14-9-12(15-10(2)13)16-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3