2-tert-butylphenol; (diphenylmethylidene)titanium(1+); 9H-fluoren-9-ide; dichloride

Systemtic Name: 2-tert-butylphenol; (diphenylmethylidene)titanium(1+); 9H-fluoren-9-ide; dichloride Openeye Name: benzhydrylidenetitanium(1+); 2-tert-butylphenol; 9H-fluoren-9-ide; dichloride CAS Name: 2-tert-butylphenol; (diphenylmethylene)titanium(1+); 9H-fluoren-9-ide; dichloride IUPAC Name: benzhydrylidenetitanium(1+); 2-tert-butylphenol; 9H-fluoren-9-ide; dichloride Traditional Name: benzhydrylidenetitanium(1+); 2-tert-butylphenol; 9H-fluoren-9-ide; dichloride Formula: C36H33Cl2OTi-2 MolecularWeight: 600.41962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1O.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.C1=CC=C(C=C1)C(=[Ti+])C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1O.[CH-]1C2=CC=CC=C2C3=CC=CC=C31.C1=CC=C(C=C1)C(=[Ti+])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/C13H9.C13H10.C10H14O.2ClH.Ti/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-10(2,3)8-6-4-5-7-9(8)11;;;/h1-9H;1-10H;4-7,11H,1-3H3;2*1H;/q-1;;;;;+1/p-2