3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-[2-(furan-2-yl)ethyl]-6-propan-2-yl-oxane-2,4-dione

Systemtic Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-[2-(furan-2-yl)ethyl]-6-propan-2-yl-oxane-2,4-dione Openeye Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-[2-(2-furyl)ethyl]-6-isopropyl-tetrahydropyran-2,4-dione CAS Name: 3-[[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]thio]-6-[2-(2-furanyl)ethyl]-6-propan-2-yloxane-2,4-dione IUPAC Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-[2-(furan-2-yl)ethyl]-6-propan-2-yloxane-2,4-dione Traditional Name: 3-[(2-tert-butyl-5-methyl-4-methylol-phenyl)thio]-6-[2-(2-furyl)ethyl]-6-isopropyl-tetrahydropyran-2,4-quinone Formula: C26H34O5S MolecularWeight: 458.61016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2C(=O)CC(OC2=O)(CCC3=CC=CO3)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2C(=O)CC(OC2=O)(CCC3=CC=CO3)C(C)C

InChI

InChI=1S/C26H34O5S/c1-16(2)26(10-9-19-8-7-11-30-19)14-21(28)23(24(29)31-26)32-22-12-17(3)18(15-27)13-20(22)25(4,5)6/h7-8,11-13,16,23,27H,9-10,14-15H2,1-6H3