methyl 2-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-cyclohexyl]sulfanylphenyl]ethanoate

Systemtic Name: methyl 2-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-cyclohexyl]sulfanylphenyl]ethanoate Openeye Name: methyl 2-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-cyclohexyl]sulfanylphenyl]acetate CAS Name: 2-[4-[[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxycyclohexyl]thio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxycyclohexyl]sulfanylphenyl]acetate Traditional Name: 2-[4-[[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-cyclohexyl]thio]phenyl]acetic acid methyl ester Formula: C26H32O6S MolecularWeight: 472.59368

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OC2CCCC(C2O)SC3=CC=C(C=C3)CC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OC2CCCC(C2O)SC3=CC=C(C=C3)CC(=O)OC

InChI

InChI=1S/C26H32O6S/c1-4-6-20-21(14-13-19(16(2)27)25(20)29)32-22-7-5-8-23(26(22)30)33-18-11-9-17(10-12-18)15-24(28)31-3/h9-14,22-23,26,29-30H,4-8,15H2,1-3H3