ethyl 3-phenyl-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: ethyl 3-phenyl-3-(phenylmethylsulfanyl)propanoate Openeye Name: ethyl 3-benzylsulfanyl-3-phenyl-propanoate CAS Name: 3-phenyl-3-(phenylmethylthio)propanoic acid ethyl ester IUPAC Name: ethyl 3-benzylsulfanyl-3-phenylpropanoate Traditional Name: 3-(benzylthio)-3-phenyl-propionic acid ethyl ester Formula: C18H20O2S MolecularWeight: 300.4152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C18H20O2S/c1-2-20-18(19)13-17(16-11-7-4-8-12-16)21-14-15-9-5-3-6-10-15/h3-12,17H,2,13-14H2,1H3