2-methyl-4-(pyridin-1-ium-1-ylmethyl)-1,2,4-triazol-4-ium-3-amine dichloride

Systemtic Name: 2-methyl-4-(pyridin-1-ium-1-ylmethyl)-1,2,4-triazol-4-ium-3-amine dichloride Openeye Name: 2-methyl-4-(pyridin-1-ium-1-ylmethyl)-1,2,4-triazol-4-ium-3-amine dichloride CAS Name: 2-methyl-4-(1-pyridin-1-iumylmethyl)-1,2,4-triazol-4-ium-3-amine dichloride IUPAC Name: 2-methyl-4-(pyridin-1-ium-1-ylmethyl)-1,2,4-triazol-4-ium-3-amine dichloride Traditional Name: [2-methyl-4-(pyridin-1-ium-1-ylmethyl)-1,2,4-triazol-4-ium-3-yl]amine dichloride Formula: C9H13Cl2N5 MolecularWeight: 262.13902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=[N+](C=N1)C[N+]2=CC=CC=C2)N.[Cl-].[Cl-]

Isomeric SMILES

CN1C(=[N+](C=N1)C[N+]2=CC=CC=C2)N.[Cl-].[Cl-]

InChI

InChI=1S/C9H12N5.2ClH/c1-12-9(10)14(7-11-12)8-13-5-3-2-4-6-13;;/h2-7,10H,8H2,1H3;2*1H/q+1;;/p-1