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

Systemtic Name: 3-methylbutyl 5-[2-ethoxy-4-[2-methyl-6-(3-methylbutoxy)-6-oxidanylidene-hexan-2-yl]-5-oxidanyl-phenyl]-5-methyl-hexanoate Openeye Name: isopentyl 5-[2-ethoxy-5-hydroxy-4-(5-isopentyloxy-1,1-dimethyl-5-oxo-pentyl)phenyl]-5-methyl-hexanoate CAS Name: 5-[2-ethoxy-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-ethoxy-5-hydroxy-4-[2-methyl-6-(3-methylbutoxy)-6-oxohexan-2-yl]phenyl]-5-methylhexanoate Traditional Name: 5-[2-ethoxy-5-hydroxy-4-(5-isoamoxy-5-keto-1,1-dimethyl-pentyl)phenyl]-5-methyl-hexanoic acid isoamyl ester Formula: C32H54O6 MolecularWeight: 534.76756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OCCC(C)C)O)C(C)(C)CCCC(=O)OCCC(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OCCC(C)C)O)C(C)(C)CCCC(=O)OCCC(C)C

InChI

InChI=1S/C32H54O6/c1-10-36-28-22-25(31(6,7)17-11-13-29(34)37-19-15-23(2)3)27(33)21-26(28)32(8,9)18-12-14-30(35)38-20-16-24(4)5/h21-24,33H,10-20H2,1-9H3