1-[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(2-isopropyl-1H-imidazol-3-ium-3-yl)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(2-isopropyl-1H-imidazol-3-ium-3-yl)ethyl]triazole-4-carboxylic acid Formula: C11H16N5O2+ MolecularWeight: 250.27704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CCN2C=C(N=N2)C(=O)O

Isomeric SMILES

CC(C)C1=[N+](C=CN1)CCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C11H15N5O2/c1-8(2)10-12-3-4-15(10)5-6-16-7-9(11(17)18)13-14-16/h3-4,7-8H,5-6H2,1-2H3,(H,17,18)/p+1