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

Systemtic Name: pentyl 5-[2-butoxy-4-(2-methyl-6-oxidanylidene-6-pentoxy-hexan-2-yl)-5-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: pentyl 5-[2-butoxy-4-(1,1-dimethyl-5-oxo-5-pentoxy-pentyl)-5-hydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[2-butoxy-5-hydroxy-4-(2-methyl-6-oxo-6-pentoxyhexan-2-yl)phenyl]-5-methylhexanoic acid pentyl ester IUPAC Name: pentyl 5-[2-butoxy-5-hydroxy-4-(2-methyl-6-oxo-6-pentoxyhexan-2-yl)phenyl]-5-methylhexanoate Traditional Name: 5-[4-(5-amoxy-5-keto-1,1-dimethyl-pentyl)-2-butoxy-5-hydroxy-phenyl]-5-methyl-hexanoic acid amyl ester Formula: C34H58O6 MolecularWeight: 562.82072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1OCCCC)C(C)(C)CCCC(=O)OCCCCC)O

Isomeric SMILES

CCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1OCCCC)C(C)(C)CCCC(=O)OCCCCC)O

InChI

InChI=1S/C34H58O6/c1-8-11-14-23-39-31(36)18-16-20-33(4,5)27-26-30(38-22-13-10-3)28(25-29(27)35)34(6,7)21-17-19-32(37)40-24-15-12-9-2/h25-26,35H,8-24H2,1-7H3