N-(3,3-diethylcyclohexyl)propanamide; propan-2-olate; propanoylazanide; titanium(3+)

Systemtic Name: N-(3,3-diethylcyclohexyl)propanamide; propan-2-olate; propanoylazanide; titanium(3+) Openeye Name: N-(3,3-diethylcyclohexyl)propanamide; propan-2-olate; propanoylazanide; titanium(3+) CAS Name: N-(3,3-diethylcyclohexyl)propanamide; 1-oxopropylazanide; 2-propanolate; titanium(3+) IUPAC Name: N-(3,3-diethylcyclohexyl)propanamide; propan-2-olate; propanoylazanide; titanium(3+) Traditional Name: N-(3,3-diethylcyclohexyl)propionamide; propan-2-olate; propionylazanide; titanium(3+) Formula: C22H45N2O4Ti MolecularWeight: 449.4707

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[NH-].CCC(=O)NC1CCCC(C1)(CC)CC.CC(C)[O-].CC(C)[O-].[Ti+3]

Isomeric SMILES

CCC(=O)[NH-].CCC(=O)NC1CCCC(C1)(CC)CC.CC(C)[O-].CC(C)[O-].[Ti+3]

InChI

InChI=1S/C13H25NO.C3H7NO.2C3H7O.Ti/c1-4-12(15)14-11-8-7-9-13(5-2,6-3)10-11;1-2-3(4)5;2*1-3(2)4;/h11H,4-10H2,1-3H3,(H,14,15);2H2,1H3,(H2,4,5);2*3H,1-2H3;/q;;2*-1;+3/p-1