iron(3+); N-[(E)-1-[4-methyl-6-[(E)-C-methyl-N-(methylamino)carbonimidoyl]pyridin-2-yl]ethylideneamino]methanamine; trichloride

Systemtic Name: iron(3+); N-[(E)-1-[4-methyl-6-[(E)-C-methyl-N-(methylamino)carbonimidoyl]pyridin-2-yl]ethylideneamino]methanamine; trichloride Openeye Name: ferric N-[(E)-1-[4-methyl-6-[(E)-C-methyl-N-(methylamino)carbonimidoyl]-2-pyridyl]ethylideneamino]methanamine trichloride CAS Name: iron(3+); N-[(E)-1-[4-methyl-6-[(1E)-1-(methylhydrazinylidene)ethyl]-2-pyridinyl]ethylideneamino]methanamine; trichloride IUPAC Name: iron(3+); N-[(E)-1-[4-methyl-6-[(E)-C-methyl-N-(methylamino)carbonimidoyl]pyridin-2-yl]ethylideneamino]methanamine; trichloride Traditional Name: ferric methyl-[(E)-1-[4-methyl-6-[(E)-C-methyl-N-(methylamino)carbonimidoyl]-2-pyridyl]ethylideneamino]amine trichloride Formula: C12H19Cl3FeN5 MolecularWeight: 395.51676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1)C(=NNC)C)C(=NNC)C.[Cl-].[Cl-].[Cl-].[Fe+3]

Isomeric SMILES

CC1=CC(=NC(=C1)/C(=N/NC)/C)/C(=N/NC)/C.[Cl-].[Cl-].[Cl-].[Fe+3]

InChI

InChI=1S/C12H19N5.3ClH.Fe/c1-8-6-11(9(2)16-13-4)15-12(7-8)10(3)17-14-5;;;;/h6-7,13-14H,1-5H3;3*1H;/q;;;;+3/p-3/b16-9+,17-10+;;;;