3,5-dipentylphenol; 2-methylcyclopenta-1,3-diene; titanium; dichloride

Systemtic Name: 3,5-dipentylphenol; 2-methylcyclopenta-1,3-diene; titanium; dichloride Openeye Name: 3,5-dipentylphenol; 2-methylcyclopenta-1,3-diene; titanium; dichloride CAS Name: 3,5-dipentylphenol; 2-methylcyclopenta-1,3-diene; titanium; dichloride IUPAC Name: 3,5-dipentylphenol; 2-methylcyclopenta-1,3-diene; titanium; dichloride Traditional Name: 3,5-diamylphenol; 2-methylcyclopenta-1,3-diene; titanium; dichloride Formula: C22H33Cl2OTi-3 MolecularWeight: 432.26982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=CC(=C1)O)CCCCC.CC1=[C-]CC=C1.[Cl-].[Cl-].[Ti]

Isomeric SMILES

CCCCCC1=CC(=CC(=C1)O)CCCCC.CC1=[C-]CC=C1.[Cl-].[Cl-].[Ti]

InChI

InChI=1S/C16H26O.C6H7.2ClH.Ti/c1-3-5-7-9-14-11-15(10-8-6-4-2)13-16(17)12-14;1-6-4-2-3-5-6;;;/h11-13,17H,3-10H2,1-2H3;2,4H,3H2,1H3;2*1H;/q;-1;;;/p-2