tris[3,5-dimethyl-2,6-bis(2-methylphenyl)phenoxy]alumane

Systemtic Name: tris[3,5-dimethyl-2,6-bis(2-methylphenyl)phenoxy]alumane Openeye Name: tris[3,5-dimethyl-2,6-bis(o-tolyl)phenoxy]alumane CAS Name: tris[3,5-dimethyl-2,6-bis(2-methylphenyl)phenoxy]alumane IUPAC Name: tris[3,5-dimethyl-2,6-bis(2-methylphenyl)phenoxy]alumane Traditional Name: tris[3,5-dimethyl-2,6-bis(o-tolyl)phenoxy]alumane Formula: C66H63AlO3 MolecularWeight: 931.186158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=C(C=C2C)C)C3=CC=CC=C3C)O[Al](OC4=C(C(=CC(=C4C5=CC=CC=C5C)C)C)C6=CC=CC=C6C)OC7=C(C(=CC(=C7C8=CC=CC=C8C)C)C)C9=CC=CC=C9C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=C(C=C2C)C)C3=CC=CC=C3C)O[Al](OC4=C(C(=CC(=C4C5=CC=CC=C5C)C)C)C6=CC=CC=C6C)OC7=C(C(=CC(=C7C8=CC=CC=C8C)C)C)C9=CC=CC=C9C

InChI

InChI=1S/3C22H22O.Al/c3*1-14-9-5-7-11-18(14)20-16(3)13-17(4)21(22(20)23)19-12-8-6-10-15(19)2;/h3*5-13,23H,1-4H3;/q;;;+3/p-3