2-[2,4-bis(2-methylbutan-2-yl)phenoxy]octanoic acid

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]octanoic acid Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]octanoic acid CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]octanoic acid IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]octanoic acid Traditional Name: 2-(2,4-ditert-amylphenoxy)caprylic acid Formula: C24H40O3 MolecularWeight: 376.5726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCCCCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C24H40O3/c1-8-11-12-13-14-21(22(25)26)27-20-16-15-18(23(4,5)9-2)17-19(20)24(6,7)10-3/h15-17,21H,8-14H2,1-7H3,(H,25,26)