carbanide; cyclohexadecane-1,5,9,13-tetramine; fluoranyltitanium(3+); dichloride

Systemtic Name: carbanide; cyclohexadecane-1,5,9,13-tetramine; fluoranyltitanium(3+); dichloride Openeye Name: carbanide; cyclohexadecane-1,5,9,13-tetramine; fluorotitanium(3+); dichloride CAS Name: carbanide; cyclohexadecane-1,5,9,13-tetramine; fluorotitanium(3+); dichloride IUPAC Name: carbanide; cyclohexadecane-1,5,9,13-tetramine; fluorotitanium(3+); dichloride Traditional Name: carbanide; fluorotitanium(3+); (5,9,13-triaminocyclohexadecyl)amine; dichloride Formula: C18H41Cl2FN4Ti-2 MolecularWeight: 451.316343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].C1CC(CCCC(CCC[C-](CCCC(C1)N)N)N)N.F[Ti+3].[Cl-].[Cl-]

Isomeric SMILES

[CH3-].[CH3-].C1CC(CCCC(CCC[C-](CCCC(C1)N)N)N)N.F[Ti+3].[Cl-].[Cl-]

InChI

InChI=1S/C16H35N4.2CH3.2ClH.FH.Ti/c17-13-5-1-6-14(18)8-3-10-16(20)12-4-11-15(19)9-2-7-13;;;;;;/h13-15H,1-12,17-20H2;2*1H3;3*1H;/q3*-1;;;;+4/p-3