2,6-ditert-butyl-4-ethyl-phenolate; methylaluminum(2+)

Systemtic Name: 2,6-ditert-butyl-4-ethyl-phenolate; methylaluminum(2+) Openeye Name: 2,6-ditert-butyl-4-ethyl-phenolate; methylaluminum(2+) CAS Name: 2,6-ditert-butyl-4-ethylphenolate; methylaluminum(2+) IUPAC Name: 2,6-ditert-butyl-4-ethylphenolate; methylaluminum(2+) Traditional Name: 2,6-ditert-butyl-4-ethyl-phenolate; methylaluminum(2+) Formula: C33H53AlO2 MolecularWeight: 508.754258

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C.CCC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C.C[Al+2]

Isomeric SMILES

CCC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C.CCC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C.C[Al+2]

InChI

InChI=1S/2C16H26O.CH3.Al/c2*1-8-11-9-12(15(2,3)4)14(17)13(10-11)16(5,6)7;;/h2*9-10,17H,8H2,1-7H3;1H3;/q;;;+2/p-2