1-methyl-5-(trifluoromethyl)-1,7-diaza-4-azanidacyclononane; titanium(3+); dichloride

Systemtic Name: 1-methyl-5-(trifluoromethyl)-1,7-diaza-4-azanidacyclononane; titanium(3+); dichloride Openeye Name: 1-methyl-5-(trifluoromethyl)-1,7-diaza-4-azanidacyclononane; titanium(3+); dichloride CAS Name: 1-methyl-5-(trifluoromethyl)-1,7-diaza-4-azanidacyclononane; titanium(3+); dichloride IUPAC Name: 1-methyl-5-(trifluoromethyl)-1,7-diaza-4-azanidacyclononane; titanium(3+); dichloride Traditional Name: 1-methyl-5-(trifluoromethyl)-1,7-diaza-4-azanidacyclononane; titanium(3+); dichloride Formula: C8H15Cl2F3N3Ti MolecularWeight: 328.99301

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNCC([N-]CC1)C(F)(F)F.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CN1CCNCC([N-]CC1)C(F)(F)F.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C8H15F3N3.2ClH.Ti/c1-14-4-2-12-6-7(8(9,10)11)13-3-5-14;;;/h7,12H,2-6H2,1H3;2*1H;/q-1;;;+3/p-2