N-(2-butyl-5,5-dimethyl-cyclohexyl)propanamide; propanoylazanide; titanium(3+); dichloride

Systemtic Name: N-(2-butyl-5,5-dimethyl-cyclohexyl)propanamide; propanoylazanide; titanium(3+); dichloride Openeye Name: N-(2-butyl-5,5-dimethyl-cyclohexyl)propanamide; propanoylazanide; titanium(3+); dichloride CAS Name: N-(2-butyl-5,5-dimethylcyclohexyl)propanamide; 1-oxopropylazanide; titanium(3+); dichloride IUPAC Name: N-(2-butyl-5,5-dimethylcyclohexyl)propanamide; propanoylazanide; titanium(3+); dichloride Traditional Name: N-(2-butyl-5,5-dimethyl-cyclohexyl)propionamide; propionylazanide; titanium(3+); dichloride Formula: C18H35Cl2N2O2Ti MolecularWeight: 430.2557

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H29NO.C3H7NO.2ClH.Ti/c1-5-7-8-12-9-10-15(3,4)11-13(12)16-14(17)6-2;1-2-3(4)5;;;/h12-13H,5-11H2,1-4H3,(H,16,17);2H2,1H3,(H2,4,5);2*1H;/q;;;;+3/p-3