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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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