butanoylazanide; N-(3,3-ditert-butylcyclohexyl)butanamide; propan-2-olate; titanium(3+)

Systemtic Name: butanoylazanide; N-(3,3-ditert-butylcyclohexyl)butanamide; propan-2-olate; titanium(3+) Openeye Name: butanoylazanide; N-(3,3-ditert-butylcyclohexyl)butanamide; propan-2-olate; titanium(3+) CAS Name: N-(3,3-ditert-butylcyclohexyl)butanamide; 1-oxobutylazanide; 2-propanolate; titanium(3+) IUPAC Name: butanoylazanide; N-(3,3-ditert-butylcyclohexyl)butanamide; propan-2-olate; titanium(3+) Traditional Name: butyrylazanide; N-(3,3-ditert-butylcyclohexyl)butyramide; propan-2-olate; titanium(3+) Formula: C28H57N2O4Ti MolecularWeight: 533.63018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H35NO.C4H9NO.2C3H7O.Ti/c1-8-10-15(20)19-14-11-9-12-18(13-14,16(2,3)4)17(5,6)7;1-2-3-4(5)6;2*1-3(2)4;/h14H,8-13H2,1-7H3,(H,19,20);2-3H2,1H3,(H2,5,6);2*3H,1-2H3;/q;;2*-1;+3/p-1