methyl 5-[2,5-diethoxy-4-(2,4,4-trimethylpentan-2-yl)phenyl]-5-methyl-hexanoate

Systemtic Name: methyl 5-[2,5-diethoxy-4-(2,4,4-trimethylpentan-2-yl)phenyl]-5-methyl-hexanoate Openeye Name: methyl 5-[2,5-diethoxy-4-(1,1,3,3-tetramethylbutyl)phenyl]-5-methyl-hexanoate CAS Name: 5-[2,5-diethoxy-4-(2,4,4-trimethylpentan-2-yl)phenyl]-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-[2,5-diethoxy-4-(2,4,4-trimethylpentan-2-yl)phenyl]-5-methylhexanoate Traditional Name: 5-[2,5-diethoxy-4-(1,1,3,3-tetramethylbutyl)phenyl]-5-methyl-hexanoic acid methyl ester Formula: C26H44O4 MolecularWeight: 420.62516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OC)OCC)C(C)(C)CC(C)(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1C(C)(C)CCCC(=O)OC)OCC)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C26H44O4/c1-11-29-21-17-20(26(8,9)18-24(3,4)5)22(30-12-2)16-19(21)25(6,7)15-13-14-23(27)28-10/h16-17H,11-15,18H2,1-10H3