2-ethylhexyl 5-[2,5-diethoxy-4-[6-(2-ethylhexoxy)-2-methyl-6-oxidanylidene-hexan-2-yl]phenyl]-5-methyl-hexanoate

Systemtic Name: 2-ethylhexyl 5-[2,5-diethoxy-4-[6-(2-ethylhexoxy)-2-methyl-6-oxidanylidene-hexan-2-yl]phenyl]-5-methyl-hexanoate Openeye Name: 2-ethylhexyl 5-[2,5-diethoxy-4-[5-(2-ethylhexoxy)-1,1-dimethyl-5-oxo-pentyl]phenyl]-5-methyl-hexanoate CAS Name: 5-[2,5-diethoxy-4-[6-(2-ethylhexoxy)-2-methyl-6-oxohexan-2-yl]phenyl]-5-methylhexanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 5-[2,5-diethoxy-4-[6-(2-ethylhexoxy)-2-methyl-6-oxohexan-2-yl]phenyl]-5-methylhexanoate Traditional Name: 5-[2,5-diethoxy-4-[5-(2-ethylhexoxy)-5-keto-1,1-dimethyl-pentyl]phenyl]-5-methyl-hexanoic acid 2-ethylhexyl ester Formula: C40H70O6 MolecularWeight: 646.9802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CCCC(C)(C)C1=CC(=C(C=C1OCC)C(C)(C)CCCC(=O)OCC(CC)CCCC)OCC

Isomeric SMILES

CCCCC(CC)COC(=O)CCCC(C)(C)C1=CC(=C(C=C1OCC)C(C)(C)CCCC(=O)OCC(CC)CCCC)OCC

InChI

InChI=1S/C40H70O6/c1-11-17-21-31(13-3)29-45-37(41)23-19-25-39(7,8)33-27-36(44-16-6)34(28-35(33)43-15-5)40(9,10)26-20-24-38(42)46-30-32(14-4)22-18-12-2/h27-28,31-32H,11-26,29-30H2,1-10H3