2-tert-butyl-4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); dichloride

Systemtic Name: 2-tert-butyl-4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); dichloride Openeye Name: 2-tert-butyl-4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); dichloride CAS Name: 2-tert-butyl-4-(3-tert-butyl-1-cyclopenta-1,3-dienyl)phenol; carbanide; methane; titanium(2+); dichloride IUPAC Name: 2-tert-butyl-4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); dichloride Traditional Name: 2-tert-butyl-4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); dichloride Formula: C22H36Cl2OTi-2 MolecularWeight: 435.29364

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Descriptors Computed from Structure

Canonical SMILES:

C.[CH3-].[CH3-].CC(C)(C)C1=CCC(=C1)C2=CC(=C(C=C2)O)C(C)(C)C.[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

C.[CH3-].[CH3-].CC(C)(C)C1=CCC(=C1)C2=CC(=C(C=C2)O)C(C)(C)C.[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C19H26O.CH4.2CH3.2ClH.Ti/c1-18(2,3)15-9-7-13(11-15)14-8-10-17(20)16(12-14)19(4,5)6;;;;;;/h8-12,20H,7H2,1-6H3;1H4;2*1H3;2*1H;/q;;2*-1;;;+2/p-2