3-phenylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene; dichloride

Systemtic Name: 3-phenylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene; dichloride Openeye Name: isopropylidenetitanium(1+); 3-phenylphenol; 1,2,3,5-tetramethylcyclopenta-1,3-diene; dichloride CAS Name: 3-phenylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene; dichloride IUPAC Name: 3-phenylphenol; propan-2-ylidenetitanium(1+); 1,2,3,5-tetramethylcyclopenta-1,3-diene; dichloride Traditional Name: isopropylidenetitanium(1+); 3-phenylphenol; 1,2,3,5-tetramethylcyclopenta-1,3-diene; dichloride Formula: C24H29Cl2OTi-2 MolecularWeight: 452.25946

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Descriptors Computed from Structure

Canonical SMILES:

CC1[C-]=C(C(=C1C)C)C.CC(=[Ti+])C.C1=CC=C(C=C1)C2=CC(=CC=C2)O.[Cl-].[Cl-]

Isomeric SMILES

CC1[C-]=C(C(=C1C)C)C.CC(=[Ti+])C.C1=CC=C(C=C1)C2=CC(=CC=C2)O.[Cl-].[Cl-]

InChI

InChI=1S/C12H10O.C9H13.C3H6.2ClH.Ti/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10;1-6-5-7(2)9(4)8(6)3;1-3-2;;;/h1-9,13H;6H,1-4H3;1-2H3;2*1H;/q;-1;;;;+1/p-2