aluminum; 2,6-diphenylphenol; 4-methylbenzaldehyde

Systemtic Name: aluminum; 2,6-diphenylphenol; 4-methylbenzaldehyde Openeye Name: aluminum; 2,6-diphenylphenol; 4-methylbenzaldehyde CAS Name: aluminum; 2,6-diphenylphenol; 4-methylbenzaldehyde IUPAC Name: aluminum; 2,6-diphenylphenol; 4-methylbenzaldehyde Traditional Name: aluminum; 2,6-diphenylphenol; 4-methylbenzaldehyde Formula: C62H50AlO4 MolecularWeight: 886.039538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=O.C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O.C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O.C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O.[Al]

Isomeric SMILES

CC1=CC=C(C=C1)C=O.C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O.C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O.C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O.[Al]

InChI

InChI=1S/3C18H14O.C8H8O.Al/c3*19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15;1-7-2-4-8(6-9)5-3-7;/h3*1-13,19H;2-6H,1H3;