chloranylnickel; [1-[6-[C-methyl-N-[oxidaniumylidene(pyridin-3-yl)methyl]azanidyl-carbonimidoyl]pyridin-2-yl]ethylideneamino]-[oxidaniumylidene(pyridin-3-yl)methyl]azanide

Systemtic Name: chloranylnickel; [1-[6-[C-methyl-N-[oxidaniumylidene(pyridin-3-yl)methyl]azanidyl-carbonimidoyl]pyridin-2-yl]ethylideneamino]-[oxidaniumylidene(pyridin-3-yl)methyl]azanide Openeye Name: chloronickel; [1-[6-[C-methyl-N-[oxoniumylidene(3-pyridyl)methyl]azanidyl-carbonimidoyl]-2-pyridyl]ethylideneamino]-[oxoniumylidene(3-pyridyl)methyl]azanide CAS Name: chloronickel; [oxoniumylidene(3-pyridinyl)methyl]-[1-[6-[1-[oxoniumylidene(3-pyridinyl)methyl]azanidyliminoethyl]-2-pyridinyl]ethylideneamino]azanide IUPAC Name: chloronickel; [1-[6-[C-methyl-N-[oxoniumylidene(pyridin-3-yl)methyl]azanidylcarbonimidoyl]pyridin-2-yl]ethylideneamino]-[oxoniumylidene(pyridin-3-yl)methyl]azanide Traditional Name: chloronickel; [1-[6-[C-methyl-N-[oxoniumylidene(3-pyridyl)methyl]azanidyl-carbonimidoyl]-2-pyridyl]ethylideneamino]-[oxoniumylidene(3-pyridyl)methyl]azanide Formula: C21H19ClN7NiO2 MolecularWeight: 495.56766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[N-]C(=[OH+])C1=CN=CC=C1)C2=NC(=CC=C2)C(=N[N-]C(=[OH+])C3=CN=CC=C3)C.Cl[Ni]

Isomeric SMILES

CC(=N[N-]C(=[OH+])C1=CN=CC=C1)C2=NC(=CC=C2)C(=N[N-]C(=[OH+])C3=CN=CC=C3)C.Cl[Ni]

InChI

InChI=1S/C21H19N7O2.ClH.Ni/c1-14(25-27-20(29)16-6-4-10-22-12-16)18-8-3-9-19(24-18)15(2)26-28-21(30)17-7-5-11-23-13-17;;/h3-13H,1-2H3,(H2,24,27,28,29,30);1H;/q;;+1/p-1