butanoylazanide; N-(2-butyl-5,5-dimethyl-cyclohexyl)butanamide; titanium(3+); dichloride

Systemtic Name: butanoylazanide; N-(2-butyl-5,5-dimethyl-cyclohexyl)butanamide; titanium(3+); dichloride Openeye Name: butanoylazanide; N-(2-butyl-5,5-dimethyl-cyclohexyl)butanamide; titanium(3+); dichloride CAS Name: N-(2-butyl-5,5-dimethylcyclohexyl)butanamide; 1-oxobutylazanide; titanium(3+); dichloride IUPAC Name: butanoylazanide; N-(2-butyl-5,5-dimethylcyclohexyl)butanamide; titanium(3+); dichloride Traditional Name: N-(2-butyl-5,5-dimethyl-cyclohexyl)butyramide; butyrylazanide; titanium(3+); dichloride Formula: C20H39Cl2N2O2Ti MolecularWeight: 458.30886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1NC(=O)CCC)(C)C.CCCC(=O)[NH-].[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CCCCC1CCC(CC1NC(=O)CCC)(C)C.CCCC(=O)[NH-].[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C16H31NO.C4H9NO.2ClH.Ti/c1-5-7-9-13-10-11-16(3,4)12-14(13)17-15(18)8-6-2;1-2-3-4(5)6;;;/h13-14H,5-12H2,1-4H3,(H,17,18);2-3H2,1H3,(H2,5,6);2*1H;/q;;;;+3/p-3