aluminum 3,7,11,15-tetramethyl-2,2-bis(2-methylpropyl)hexadecanoate

Systemtic Name: aluminum 3,7,11,15-tetramethyl-2,2-bis(2-methylpropyl)hexadecanoate Openeye Name: aluminum 2,2-diisobutyl-3,7,11,15-tetramethyl-hexadecanoate CAS Name: aluminum 3,7,11,15-tetramethyl-2,2-bis(2-methylpropyl)hexadecanoate IUPAC Name: aluminum 3,7,11,15-tetramethyl-2,2-bis(2-methylpropyl)hexadecanoate Traditional Name: aluminum 2,2-diisobutyl-3,7,11,15-tetramethyl-palmitate Formula: C84H165AlO6 MolecularWeight: 1298.186838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(C)C(CC(C)C)(CC(C)C)C(=O)[O-].CC(C)CCCC(C)CCCC(C)CCCC(C)C(CC(C)C)(CC(C)C)C(=O)[O-].CC(C)CCCC(C)CCCC(C)CCCC(C)C(CC(C)C)(CC(C)C)C(=O)[O-].[Al+3]

Isomeric SMILES

CC(C)CCCC(C)CCCC(C)CCCC(C)C(CC(C)C)(CC(C)C)C(=O)[O-].CC(C)CCCC(C)CCCC(C)CCCC(C)C(CC(C)C)(CC(C)C)C(=O)[O-].CC(C)CCCC(C)CCCC(C)CCCC(C)C(CC(C)C)(CC(C)C)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C28H56O2.Al/c3*1-21(2)13-10-14-24(7)15-11-16-25(8)17-12-18-26(9)28(27(29)30,19-22(3)4)20-23(5)6;/h3*21-26H,10-20H2,1-9H3,(H,29,30);/q;;;+3/p-3