2,6-bis(2-methylbutan-2-yl)phenolate; di(propan-2-yloxy)alumanylium

Systemtic Name: 2,6-bis(2-methylbutan-2-yl)phenolate; di(propan-2-yloxy)alumanylium Openeye Name: 2,6-bis(1,1-dimethylpropyl)phenolate; diisopropoxyalumanylium CAS Name: 2,6-bis(2-methylbutan-2-yl)phenolate; di(propan-2-yloxy)alumanylium IUPAC Name: 2,6-bis(2-methylbutan-2-yl)phenolate; di(propan-2-yloxy)alumanylium Traditional Name: 2,6-ditert-amylphenolate; diisopropoxyalumanylium Formula: C22H39AlO3 MolecularWeight: 378.524798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(C(=CC=C1)C(C)(C)CC)[O-].CC(C)O[Al+]OC(C)C

Isomeric SMILES

CCC(C)(C)C1=C(C(=CC=C1)C(C)(C)CC)[O-].CC(C)O[Al+]OC(C)C

InChI

InChI=1S/C16H26O.2C3H7O.Al/c1-7-15(3,4)12-10-9-11-13(14(12)17)16(5,6)8-2;2*1-3(2)4;/h9-11,17H,7-8H2,1-6H3;2*3H,1-2H3;/q;2*-1;+3/p-1