3-tert-butyl-5-methoxy-phenol; 2-methylcyclopenta-1,3-diene; methylidenetitanium(1+); dichloride

Systemtic Name: 3-tert-butyl-5-methoxy-phenol; 2-methylcyclopenta-1,3-diene; methylidenetitanium(1+); dichloride Openeye Name: 3-tert-butyl-5-methoxy-phenol; 2-methylcyclopenta-1,3-diene; methylenetitanium(1+); dichloride CAS Name: 3-tert-butyl-5-methoxyphenol; 2-methylcyclopenta-1,3-diene; methylenetitanium(1+); dichloride IUPAC Name: 3-tert-butyl-5-methoxyphenol; 2-methylcyclopenta-1,3-diene; methylidenetitanium(1+); dichloride Traditional Name: 3-tert-butyl-5-methoxy-phenol; 2-methylcyclopenta-1,3-diene; methylenetitanium(1+); dichloride Formula: C18H25Cl2O2Ti-2 MolecularWeight: 392.1629

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O2.C6H7.CH2.2ClH.Ti/c1-11(2,3)8-5-9(12)7-10(6-8)13-4;1-6-4-2-3-5-6;;;;/h5-7,12H,1-4H3;2,4H,3H2,1H3;1H2;2*1H;/q;-1;;;;+1/p-2