2-tert-butyl-4-methoxy-phenolate; methylaluminum(2+)

Systemtic Name: 2-tert-butyl-4-methoxy-phenolate; methylaluminum(2+) Openeye Name: 2-tert-butyl-4-methoxy-phenolate; methylaluminum(2+) CAS Name: 2-tert-butyl-4-methoxyphenolate; methylaluminum(2+) IUPAC Name: 2-tert-butyl-4-methoxyphenolate; methylaluminum(2+) Traditional Name: 2-tert-butyl-4-methoxy-phenolate; methylaluminum(2+) Formula: C23H33AlO4 MolecularWeight: 400.487258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C11H16O2.CH3.Al/c2*1-11(2,3)9-7-8(13-4)5-6-10(9)12;;/h2*5-7,12H,1-4H3;1H3;/q;;;+2/p-2