2-ethanoylsulfanyl-4-(4-phenylphenyl)pentanoic acid

Systemtic Name: 2-ethanoylsulfanyl-4-(4-phenylphenyl)pentanoic acid Openeye Name: 2-acetylsulfanyl-4-(4-phenylphenyl)pentanoic acid CAS Name: 2-(acetylthio)-4-(4-phenylphenyl)pentanoic acid IUPAC Name: 2-acetylsulfanyl-4-(4-phenylphenyl)pentanoic acid Traditional Name: 2-(acetylthio)-4-(4-phenylphenyl)valeric acid Formula: C19H20O3S MolecularWeight: 328.4253

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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