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

Systemtic Name: 3-methyl-N-(1,2,4-triazol-1-ylmethyl)pyridin-1-ium-2-amine Openeye Name: 3-methyl-N-(1,2,4-triazol-1-ylmethyl)pyridin-1-ium-2-amine CAS Name: 3-methyl-N-(1,2,4-triazol-1-ylmethyl)-2-pyridin-1-iumamine IUPAC Name: 3-methyl-N-(1,2,4-triazol-1-ylmethyl)pyridin-1-ium-2-amine Traditional Name: (3-methylpyridin-1-ium-2-yl)-(1,2,4-triazol-1-ylmethyl)amine Formula: C9H12N5+ MolecularWeight: 190.22508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=CC=C1)NCN2C=NC=N2

Isomeric SMILES

CC1=C([NH+]=CC=C1)NCN2C=NC=N2

InChI

InChI=1S/C9H11N5/c1-8-3-2-4-11-9(8)12-7-14-6-10-5-13-14/h2-6H,7H2,1H3,(H,11,12)/p+1