ethyl 5-phenylsulfanylpent-3-ynoate

Systemtic Name: ethyl 5-phenylsulfanylpent-3-ynoate Openeye Name: ethyl 5-phenylsulfanylpent-3-ynoate CAS Name: 5-(phenylthio)-3-pentynoic acid ethyl ester IUPAC Name: ethyl 5-phenylsulfanylpent-3-ynoate Traditional Name: 5-(phenylthio)pent-3-ynoic acid ethyl ester Formula: C13H14O2S MolecularWeight: 234.31406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC#CCSC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CC#CCSC1=CC=CC=C1

InChI

InChI=1S/C13H14O2S/c1-2-15-13(14)10-6-7-11-16-12-8-4-3-5-9-12/h3-5,8-9H,2,10-11H2,1H3