(2-pentylsulfanylphenyl) ethanoate

Systemtic Name: (2-pentylsulfanylphenyl) ethanoate Openeye Name: (2-pentylsulfanylphenyl) acetate CAS Name: acetic acid [2-(pentylthio)phenyl] ester IUPAC Name: (2-pentylsulfanylphenyl) acetate Traditional Name: acetic acid [2-(amylthio)phenyl] ester Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=CC=CC=C1OC(=O)C

Isomeric SMILES

CCCCCSC1=CC=CC=C1OC(=O)C

InChI

InChI=1S/C13H18O2S/c1-3-4-7-10-16-13-9-6-5-8-12(13)15-11(2)14/h5-6,8-9H,3-4,7,10H2,1-2H3