propanimidate; titanium(3+); N-(2,5,5-trimethylcyclohexyl)propanamide; dichloride

Systemtic Name: propanimidate; titanium(3+); N-(2,5,5-trimethylcyclohexyl)propanamide; dichloride Openeye Name: propanimidate; titanium(3+); N-(2,5,5-trimethylcyclohexyl)propanamide; dichloride CAS Name: propanimidate; titanium(3+); N-(2,5,5-trimethylcyclohexyl)propanamide; dichloride IUPAC Name: propanimidate; titanium(3+); N-(2,5,5-trimethylcyclohexyl)propanamide; dichloride Traditional Name: propionimidate; titanium(3+); N-(2,5,5-trimethylcyclohexyl)propionamide; dichloride Formula: C15H29Cl2N2O2Ti MolecularWeight: 388.17596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=N)[O-].CCC(=O)NC1CC(CCC1C)(C)C.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CCC(=N)[O-].CCC(=O)NC1CC(CCC1C)(C)C.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C12H23NO.C3H7NO.2ClH.Ti/c1-5-11(14)13-10-8-12(3,4)7-6-9(10)2;1-2-3(4)5;;;/h9-10H,5-8H2,1-4H3,(H,13,14);2H2,1H3,(H2,4,5);2*1H;/q;;;;+3/p-3