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

Systemtic Name: pentyl 5-methyl-5-[4-(2-methyl-6-oxidanylidene-6-pentoxy-hexan-2-yl)-2,5-bis(oxidanyl)phenyl]hexanoate Openeye Name: pentyl 5-[4-(1,1-dimethyl-5-oxo-5-pentoxy-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoate CAS Name: 5-[2,5-dihydroxy-4-(2-methyl-6-oxo-6-pentoxyhexan-2-yl)phenyl]-5-methylhexanoic acid pentyl ester IUPAC Name: pentyl 5-[2,5-dihydroxy-4-(2-methyl-6-oxo-6-pentoxyhexan-2-yl)phenyl]-5-methylhexanoate Traditional Name: 5-[4-(5-amoxy-5-keto-1,1-dimethyl-pentyl)-2,5-dihydroxy-phenyl]-5-methyl-hexanoic acid amyl ester Formula: C30H50O6 MolecularWeight: 506.7144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCCC(=O)OCCCCC)O

Isomeric SMILES

CCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCCC(=O)OCCCCC)O

InChI

InChI=1S/C30H50O6/c1-7-9-11-19-35-27(33)15-13-17-29(3,4)23-21-26(32)24(22-25(23)31)30(5,6)18-14-16-28(34)36-20-12-10-8-2/h21-22,31-32H,7-20H2,1-6H3