methyl 2-ethanoylsulfanyl-4-(4-phenylphenyl)butanoate

Systemtic Name: methyl 2-ethanoylsulfanyl-4-(4-phenylphenyl)butanoate Openeye Name: methyl 2-acetylsulfanyl-4-(4-phenylphenyl)butanoate CAS Name: 2-(acetylthio)-4-(4-phenylphenyl)butanoic acid methyl ester IUPAC Name: methyl 2-acetylsulfanyl-4-(4-phenylphenyl)butanoate Traditional Name: 2-(acetylthio)-4-(4-phenylphenyl)butyric acid methyl ester Formula: C19H20O3S MolecularWeight: 328.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(=O)SC(CCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)OC

InChI

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