[2-(1-sulfanylpent-2-ynyl)phenyl] ethanoate

Systemtic Name: [2-(1-sulfanylpent-2-ynyl)phenyl] ethanoate Openeye Name: [2-(1-sulfanylpent-2-ynyl)phenyl] acetate CAS Name: acetic acid [2-(1-mercaptopent-2-ynyl)phenyl] ester IUPAC Name: [2-(1-sulfanylpent-2-ynyl)phenyl] acetate Traditional Name: acetic acid [2-(1-mercaptopent-2-ynyl)phenyl] ester Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC(C1=CC=CC=C1OC(=O)C)S

Isomeric SMILES

CCC#CC(C1=CC=CC=C1OC(=O)C)S

InChI

InChI=1S/C13H14O2S/c1-3-4-9-13(16)11-7-5-6-8-12(11)15-10(2)14/h5-8,13,16H,3H2,1-2H3