(2-non-2-ynylsulfanylphenyl) ethanoate

Systemtic Name: (2-non-2-ynylsulfanylphenyl) ethanoate Openeye Name: (2-non-2-ynylsulfanylphenyl) acetate CAS Name: acetic acid [2-(non-2-ynylthio)phenyl] ester IUPAC Name: (2-non-2-ynylsulfanylphenyl) acetate Traditional Name: acetic acid [2-(non-2-ynylthio)phenyl] ester Formula: C17H22O2S MolecularWeight: 290.42038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CCSC1=CC=CC=C1OC(=O)C

Isomeric SMILES

CCCCCCC#CCSC1=CC=CC=C1OC(=O)C

InChI

InChI=1S/C17H22O2S/c1-3-4-5-6-7-8-11-14-20-17-13-10-9-12-16(17)19-15(2)18/h9-10,12-13H,3-7,14H2,1-2H3