1-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]triazole-4-carboxylate CAS Name: 1-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]triazole-4-carboxylate Traditional Name: 1-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]triazole-4-carboxylate Formula: C9H11N5O2 MolecularWeight: 221.21594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CCN2C=C(N=N2)C(=O)[O-]

Isomeric SMILES

CC1=[N+](C=CN1)CCN2C=C(N=N2)C(=O)[O-]

InChI

InChI=1S/C9H11N5O2/c1-7-10-2-3-13(7)4-5-14-6-8(9(15)16)11-12-14/h2-3,6H,4-5H2,1H3,(H,15,16)