2-tert-butylcyclopenta-1,3-diene; 3-methyl-5-phenyl-phenol; titanium; dichloride

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; 3-methyl-5-phenyl-phenol; titanium; dichloride Openeye Name: 2-tert-butylcyclopenta-1,3-diene; 3-methyl-5-phenyl-phenol; titanium; dichloride CAS Name: 2-tert-butylcyclopenta-1,3-diene; 3-methyl-5-phenylphenol; titanium; dichloride IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; 3-methyl-5-phenylphenol; titanium; dichloride Traditional Name: 2-tert-butylcyclopenta-1,3-diene; 3-methyl-5-phenyl-phenol; titanium; dichloride Formula: C22H25Cl2OTi-3 MolecularWeight: 424.2063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC=CC=C2)O.CC(C)(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Ti]

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC=CC=C2)O.CC(C)(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Ti]

InChI

InChI=1S/C13H12O.C9H13.2ClH.Ti/c1-10-7-12(9-13(14)8-10)11-5-3-2-4-6-11;1-9(2,3)8-6-4-5-7-8;;;/h2-9,14H,1H3;4,6H,5H2,1-3H3;2*1H;/q;-1;;;/p-2