2-[[2,2,4-trimethyl-7-(2-methylheptan-2-yl)-3,4-dihydrochromen-6-yl]oxy]octanoate

Systemtic Name: 2-[[2,2,4-trimethyl-7-(2-methylheptan-2-yl)-3,4-dihydrochromen-6-yl]oxy]octanoate Openeye Name: 2-[7-(1,1-dimethylhexyl)-2,2,4-trimethyl-chroman-6-yl]oxyoctanoate CAS Name: 2-[[2,2,4-trimethyl-7-(2-methylheptan-2-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]oxy]octanoate IUPAC Name: 2-[[2,2,4-trimethyl-7-(2-methylheptan-2-yl)-3,4-dihydrochromen-6-yl]oxy]octanoate Traditional Name: 2-[7-(1,1-dimethylhexyl)-2,2,4-trimethyl-chroman-6-yl]oxycaprylate Formula: C28H45O4- MolecularWeight: 445.6545

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)[O-])OC1=C(C=C2C(=C1)C(CC(O2)(C)C)C)C(C)(C)CCCCC

Isomeric SMILES

CCCCCCC(C(=O)[O-])OC1=C(C=C2C(=C1)C(CC(O2)(C)C)C)C(C)(C)CCCCC

InChI

InChI=1S/C28H46O4/c1-8-10-12-13-15-23(26(29)30)31-25-17-21-20(3)19-28(6,7)32-24(21)18-22(25)27(4,5)16-14-11-9-2/h17-18,20,23H,8-16,19H2,1-7H3,(H,29,30)/p-1