butanoylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)butanamide; dichloride

Systemtic Name: butanoylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)butanamide; dichloride Openeye Name: butanoylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)butanamide; dichloride CAS Name: 1-oxobutylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)butanamide; dichloride IUPAC Name: butanoylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)butanamide; dichloride Traditional Name: butyrylazanide; titanium(3+); N-(2,5,5-trimethylcyclohexyl)butyramide; dichloride Formula: C17H33Cl2N2O2Ti MolecularWeight: 416.22912

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[NH-].CCCC(=O)NC1CC(CCC1C)(C)C.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CCCC(=O)[NH-].CCCC(=O)NC1CC(CCC1C)(C)C.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C13H25NO.C4H9NO.2ClH.Ti/c1-5-6-12(15)14-11-9-13(3,4)8-7-10(11)2;1-2-3-4(5)6;;;/h10-11H,5-9H2,1-4H3,(H,14,15);2-3H2,1H3,(H2,5,6);2*1H;/q;;;;+3/p-3