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

Systemtic Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; titanium(2+); dichloride Openeye Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; titanium(2+); dichloride CAS Name: carbanide; methane; 4-(3-methyl-1-cyclopenta-1,3-dienyl)phenol; titanium(2+); dichloride IUPAC Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; titanium(2+); dichloride Traditional Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; titanium(2+); dichloride Formula: C15H22Cl2OTi-2 MolecularWeight: 337.10758

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Descriptors Computed from Structure

Canonical SMILES:

C.[CH3-].[CH3-].CC1=CCC(=C1)C2=CC=C(C=C2)O.[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

C.[CH3-].[CH3-].CC1=CCC(=C1)C2=CC=C(C=C2)O.[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C12H12O.CH4.2CH3.2ClH.Ti/c1-9-2-3-11(8-9)10-4-6-12(13)7-5-10;;;;;;/h2,4-8,13H,3H2,1H3;1H4;2*1H3;2*1H;/q;;2*-1;;;+2/p-2