5,6-bis(chloranyl)-N-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-pyrimidin-4-amine chloride

Systemtic Name: 5,6-bis(chloranyl)-N-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-pyrimidin-4-amine chloride Openeye Name: 5,6-dichloro-N-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-pyrimidin-4-amine chloride CAS Name: 5,6-dichloro-N-(4-nitrophenyl)-2-(1-pyridin-1-iumyl)-4-pyrimidinamine chloride IUPAC Name: 5,6-dichloro-N-(4-nitrophenyl)-2-pyridin-1-ium-1-ylpyrimidin-4-amine chloride Traditional Name: (5,6-dichloro-2-pyridin-1-ium-1-yl-pyrimidin-4-yl)-(4-nitrophenyl)amine chloride Formula: C15H10Cl3N5O2 MolecularWeight: 398.6312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C2=NC(=C(C(=N2)Cl)Cl)NC3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C2=NC(=C(C(=N2)Cl)Cl)NC3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C15H10Cl2N5O2.ClH/c16-12-13(17)19-15(21-8-2-1-3-9-21)20-14(12)18-10-4-6-11(7-5-10)22(23)24;/h1-9H,(H,18,19,20);1H/q+1;/p-1