2-tert-butylcyclopenta-1,3-diene; 3-tert-butylphenol; methylidenetitanium(1+); dichloride

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butylphenol; methylidenetitanium(1+); dichloride Openeye Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butylphenol; methylenetitanium(1+); dichloride CAS Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butylphenol; methylenetitanium(1+); dichloride IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butylphenol; methylidenetitanium(1+); dichloride Traditional Name: 2-tert-butylcyclopenta-1,3-diene; 3-tert-butylphenol; methylenetitanium(1+); dichloride Formula: C20H29Cl2OTi-2 MolecularWeight: 404.21666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O.C9H13.CH2.2ClH.Ti/c1-10(2,3)8-5-4-6-9(11)7-8;1-9(2,3)8-6-4-5-7-8;;;;/h4-7,11H,1-3H3;4,6H,5H2,1-3H3;1H2;2*1H;/q;-1;;;;+1/p-2