5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-[2-(4-hydroxyphenyl)ethyl]-4-methyl-2-propan-2-yl-3H-pyran-6-one

Systemtic Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-[2-(4-hydroxyphenyl)ethyl]-4-methyl-2-propan-2-yl-3H-pyran-6-one Openeye Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-4-methyl-3H-pyran-6-one CAS Name: 5-[[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]thio]-2-[2-(4-hydroxyphenyl)ethyl]-4-methyl-2-propan-2-yl-3H-pyran-6-one IUPAC Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-2-[2-(4-hydroxyphenyl)ethyl]-4-methyl-2-propan-2-yl-3H-pyran-6-one Traditional Name: 5-[(2-tert-butyl-5-methyl-4-methylol-phenyl)thio]-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-4-methyl-3H-pyran-6-one Formula: C29H38O4S MolecularWeight: 482.67462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC(C1)(CCC2=CC=C(C=C2)O)C(C)C)SC3=C(C=C(C(=C3)C)CO)C(C)(C)C

Isomeric SMILES

CC1=C(C(=O)OC(C1)(CCC2=CC=C(C=C2)O)C(C)C)SC3=C(C=C(C(=C3)C)CO)C(C)(C)C

InChI

InChI=1S/C29H38O4S/c1-18(2)29(13-12-21-8-10-23(31)11-9-21)16-20(4)26(27(32)33-29)34-25-14-19(3)22(17-30)15-24(25)28(5,6)7/h8-11,14-15,18,30-31H,12-13,16-17H2,1-7H3