3-methylbutyl 5-[2-butoxy-4-[2-methyl-6-(3-methylbutoxy)-6-oxidanylidene-hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate

Systemtic Name: 3-methylbutyl 5-[2-butoxy-4-[2-methyl-6-(3-methylbutoxy)-6-oxidanylidene-hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: isopentyl 5-[2-butoxy-5-hydroxy-4-(5-isopentyloxy-1,1-dimethyl-5-oxo-pentyl)phenyl]-5-methyl-hexanoate CAS Name: 5-[2-butoxy-5-hydroxy-4-[2-methyl-6-(3-methylbutoxy)-6-oxohexan-2-yl]phenyl]-5-methylhexanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 5-[2-butoxy-5-hydroxy-4-[2-methyl-6-(3-methylbutoxy)-6-oxohexan-2-yl]phenyl]-5-methylhexanoate Traditional Name: 5-[2-butoxy-5-hydroxy-4-(5-isoamoxy-5-keto-1,1-dimethyl-pentyl)phenyl]-5-methyl-hexanoic acid isoamyl ester Formula: C34H58O6 MolecularWeight: 562.82072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OCCC(C)C)O)C(C)(C)CCCC(=O)OCCC(C)C

Isomeric SMILES

CCCCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OCCC(C)C)O)C(C)(C)CCCC(=O)OCCC(C)C

InChI

InChI=1S/C34H58O6/c1-10-11-20-38-30-24-27(33(6,7)18-12-14-31(36)39-21-16-25(2)3)29(35)23-28(30)34(8,9)19-13-15-32(37)40-22-17-26(4)5/h23-26,35H,10-22H2,1-9H3