3-ethyl-5-methyl-4-(phenylsulfanylmethyl)oxolan-2-one

Systemtic Name: 3-ethyl-5-methyl-4-(phenylsulfanylmethyl)oxolan-2-one Openeye Name: 3-ethyl-5-methyl-4-(phenylsulfanylmethyl)tetrahydrofuran-2-one CAS Name: 3-ethyl-5-methyl-4-[(phenylthio)methyl]-2-oxolanone IUPAC Name: 3-ethyl-5-methyl-4-(phenylsulfanylmethyl)oxolan-2-one Traditional Name: 3-ethyl-5-methyl-4-[(phenylthio)methyl]tetrahydrofuran-2-one Formula: C14H18O2S MolecularWeight: 250.35652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(OC1=O)C)CSC2=CC=CC=C2

Isomeric SMILES

CCC1C(C(OC1=O)C)CSC2=CC=CC=C2

InChI

InChI=1S/C14H18O2S/c1-3-12-13(10(2)16-14(12)15)9-17-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9H2,1-2H3