2-[2,4-bis(2,4,4-trimethylpentan-2-yl)phenoxy]octanoyl chloride

Systemtic Name: 2-[2,4-bis(2,4,4-trimethylpentan-2-yl)phenoxy]octanoyl chloride Openeye Name: 2-[2,4-bis(1,1,3,3-tetramethylbutyl)phenoxy]octanoyl chloride CAS Name: 2-[2,4-bis(2,4,4-trimethylpentan-2-yl)phenoxy]octanoyl chloride IUPAC Name: 2-[2,4-bis(2,4,4-trimethylpentan-2-yl)phenoxy]octanoyl chloride Traditional Name: 2-[2,4-bis(1,1,3,3-tetramethylbutyl)phenoxy]caprylyl chloride Formula: C30H51ClO2 MolecularWeight: 479.17774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H51ClO2/c1-12-13-14-15-16-25(26(31)32)33-24-18-17-22(29(8,9)20-27(2,3)4)19-23(24)30(10,11)21-28(5,6)7/h17-19,25H,12-16,20-21H2,1-11H3