aluminum 4-(4-cyanophenyl)phenolate

Systemtic Name: aluminum 4-(4-cyanophenyl)phenolate Openeye Name: aluminum 4-(4-cyanophenyl)phenolate CAS Name: aluminum 4-(4-cyanophenyl)phenolate IUPAC Name: aluminum 4-(4-cyanophenyl)phenolate Traditional Name: aluminum 4-(4-cyanophenyl)phenolate Formula: C39H24AlN3O3 MolecularWeight: 609.607698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[O-].C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[O-].C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[O-].[Al+3]

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[O-].C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[O-].C1=CC(=CC=C1C#N)C2=CC=C(C=C2)[O-].[Al+3]

InChI

InChI=1S/3C13H9NO.Al/c3*14-9-10-1-3-11(4-2-10)12-5-7-13(15)8-6-12;/h3*1-8,15H;/q;;;+3/p-3