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

Systemtic Name: heptyl 5-[2-butoxy-4-(6-heptoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-5-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: heptyl 5-[2-butoxy-4-(5-heptoxy-1,1-dimethyl-5-oxo-pentyl)-5-hydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[2-butoxy-4-(6-heptoxy-2-methyl-6-oxohexan-2-yl)-5-hydroxyphenyl]-5-methylhexanoic acid heptyl ester IUPAC Name: heptyl 5-[2-butoxy-4-(6-heptoxy-2-methyl-6-oxohexan-2-yl)-5-hydroxyphenyl]-5-methylhexanoate Traditional Name: 5-[2-butoxy-4-(5-heptoxy-5-keto-1,1-dimethyl-pentyl)-5-hydroxy-phenyl]-5-methyl-hexanoic acid heptyl ester Formula: C38H66O6 MolecularWeight: 618.92704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1OCCCC)C(C)(C)CCCC(=O)OCCCCCCC)O

Isomeric SMILES

CCCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1OCCCC)C(C)(C)CCCC(=O)OCCCCCCC)O

InChI

InChI=1S/C38H66O6/c1-8-11-14-16-18-27-43-35(40)22-20-24-37(4,5)31-30-34(42-26-13-10-3)32(29-33(31)39)38(6,7)25-21-23-36(41)44-28-19-17-15-12-9-2/h29-30,39H,8-28H2,1-7H3