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

Systemtic Name: 2,3-dimethyl-4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; methane; titanium(2+); dichloride Openeye Name: 2,3-dimethyl-4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; methane; titanium(2+); dichloride CAS Name: 2,3-dimethyl-4-(3-methyl-1-cyclopenta-1,3-dienyl)phenol; methane; titanium(2+); dichloride IUPAC Name: 2,3-dimethyl-4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; methane; titanium(2+); dichloride Traditional Name: 2,3-dimethyl-4-(3-methylcyclopenta-1,3-dien-1-yl)phenol; methane; titanium(2+); dichloride Formula: C15H20Cl2OTi MolecularWeight: 335.0917

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O.CH4.2ClH.Ti/c1-9-4-5-12(8-9)13-6-7-14(15)11(3)10(13)2;;;;/h4,6-8,15H,5H2,1-3H3;1H4;2*1H;/q;;;;+2/p-2