2-phenoxyethyl 5-[2-butoxy-4-[2-methyl-6-oxidanylidene-6-(2-phenoxyethoxy)hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate

Systemtic Name: 2-phenoxyethyl 5-[2-butoxy-4-[2-methyl-6-oxidanylidene-6-(2-phenoxyethoxy)hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: 2-phenoxyethyl 5-[2-butoxy-4-[1,1-dimethyl-5-oxo-5-(2-phenoxyethoxy)pentyl]-5-hydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[2-butoxy-5-hydroxy-4-[2-methyl-6-oxo-6-(2-phenoxyethoxy)hexan-2-yl]phenyl]-5-methylhexanoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 5-[2-butoxy-5-hydroxy-4-[2-methyl-6-oxo-6-(2-phenoxyethoxy)hexan-2-yl]phenyl]-5-methylhexanoate Traditional Name: 5-[2-butoxy-5-hydroxy-4-[5-keto-1,1-dimethyl-5-(2-phenoxyethoxy)pentyl]phenyl]-5-methyl-hexanoic acid 2-phenoxyethyl ester Formula: C40H54O8 MolecularWeight: 662.85196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OCCOC2=CC=CC=C2)O)C(C)(C)CCCC(=O)OCCOC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OCCOC2=CC=CC=C2)O)C(C)(C)CCCC(=O)OCCOC3=CC=CC=C3

InChI

InChI=1S/C40H54O8/c1-6-7-24-46-36-30-33(39(2,3)22-14-20-37(42)47-27-25-44-31-16-10-8-11-17-31)35(41)29-34(36)40(4,5)23-15-21-38(43)48-28-26-45-32-18-12-9-13-19-32/h8-13,16-19,29-30,41H,6-7,14-15,20-28H2,1-5H3