3,5-dimethylphenol; 2-methylcyclopenta-1,3-diene; propan-2-ylidenetitanium(1+); dichloride

Systemtic Name: 3,5-dimethylphenol; 2-methylcyclopenta-1,3-diene; propan-2-ylidenetitanium(1+); dichloride Openeye Name: 3,5-dimethylphenol; isopropylidenetitanium(1+); 2-methylcyclopenta-1,3-diene; dichloride CAS Name: 3,5-dimethylphenol; 2-methylcyclopenta-1,3-diene; propan-2-ylidenetitanium(1+); dichloride IUPAC Name: 3,5-dimethylphenol; 2-methylcyclopenta-1,3-diene; propan-2-ylidenetitanium(1+); dichloride Traditional Name: isopropylidenetitanium(1+); 2-methylcyclopenta-1,3-diene; 3,5-xylenol; dichloride Formula: C17H23Cl2OTi-2 MolecularWeight: 362.13692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10O.C6H7.C3H6.2ClH.Ti/c1-6-3-7(2)5-8(9)4-6;1-6-4-2-3-5-6;1-3-2;;;/h3-5,9H,1-2H3;2,4H,3H2,1H3;1-2H3;2*1H;/q;-1;;;;+1/p-2