methyl 3-ethanoylsulfanyl-4-(4-phenylphenyl)butanoate

Systemtic Name: methyl 3-ethanoylsulfanyl-4-(4-phenylphenyl)butanoate Openeye Name: methyl 3-acetylsulfanyl-4-(4-phenylphenyl)butanoate CAS Name: 3-(acetylthio)-4-(4-phenylphenyl)butanoic acid methyl ester IUPAC Name: methyl 3-acetylsulfanyl-4-(4-phenylphenyl)butanoate Traditional Name: 3-(acetylthio)-4-(4-phenylphenyl)butyric acid methyl ester Formula: C19H20O3S MolecularWeight: 328.4253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC1=CC=C(C=C1)C2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC(=O)SC(CC1=CC=C(C=C1)C2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C19H20O3S/c1-14(20)23-18(13-19(21)22-2)12-15-8-10-17(11-9-15)16-6-4-3-5-7-16/h3-11,18H,12-13H2,1-2H3