magnesium 4-tert-butyl-2,6-diphenyl-phenolate

Systemtic Name: magnesium 4-tert-butyl-2,6-diphenyl-phenolate Openeye Name: magnesium 4-tert-butyl-2,6-diphenyl-phenolate CAS Name: magnesium 4-tert-butyl-2,6-diphenylphenolate IUPAC Name: magnesium 4-tert-butyl-2,6-diphenylphenolate Traditional Name: magnesium 4-tert-butyl-2,6-diphenyl-phenolate Formula: C44H42MgO2 MolecularWeight: 627.10808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)[O-])C3=CC=CC=C3.CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)[O-])C3=CC=CC=C3.[Mg+2]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)[O-])C3=CC=CC=C3.CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)[O-])C3=CC=CC=C3.[Mg+2]

InChI

InChI=1S/2C22H22O.Mg/c2*1-22(2,3)18-14-19(16-10-6-4-7-11-16)21(23)20(15-18)17-12-8-5-9-13-17;/h2*4-15,23H,1-3H3;/q;;+2/p-2