4,4-dimethyl-5-[6-oxidanyl-4-oxidanylidene-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]pentanoic acid

Systemtic Name: 4,4-dimethyl-5-[6-oxidanyl-4-oxidanylidene-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]pentanoic acid Openeye Name: 5-[6-hydroxy-5-(2-isopropylphenyl)sulfanyl-4-oxo-2-phenyl-3H-pyran-2-yl]-4,4-dimethyl-pentanoic acid CAS Name: 5-[6-hydroxy-4-oxo-2-phenyl-5-[(2-propan-2-ylphenyl)thio]-3H-pyran-2-yl]-4,4-dimethylpentanoic acid IUPAC Name: 5-[6-hydroxy-4-oxo-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]-4,4-dimethylpentanoic acid Traditional Name: 5-[6-hydroxy-4-keto-5-(o-cumenylthio)-2-phenyl-3H-pyran-2-yl]-4,4-dimethyl-valeric acid Formula: C27H32O5S MolecularWeight: 468.60498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(CC2=O)(CC(C)(C)CCC(=O)O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(CC2=O)(CC(C)(C)CCC(=O)O)C3=CC=CC=C3)O

InChI

InChI=1S/C27H32O5S/c1-18(2)20-12-8-9-13-22(20)33-24-21(28)16-27(32-25(24)31,19-10-6-5-7-11-19)17-26(3,4)15-14-23(29)30/h5-13,18,31H,14-17H2,1-4H3,(H,29,30)