ethanoylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)ethanamide; dichloride

Systemtic Name: ethanoylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)ethanamide; dichloride Openeye Name: acetylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)acetamide; dichloride CAS Name: acetylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)acetamide; dichloride IUPAC Name: acetylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)acetamide; dichloride Traditional Name: acetylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)acetamide; dichloride Formula: C13H25Cl2N2O2Ti MolecularWeight: 360.1228

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1NC(=O)C)(C)C.CC(=O)[NH-].[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CC1CCC(CC1NC(=O)C)(C)C.CC(=O)[NH-].[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C11H21NO.C2H5NO.2ClH.Ti/c1-8-5-6-11(3,4)7-10(8)12-9(2)13;1-2(3)4;;;/h8,10H,5-7H2,1-4H3,(H,12,13);1H3,(H2,3,4);2*1H;/q;;;;+3/p-3