(1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2-methylpropanoate chloride

Systemtic Name: (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2-methylpropanoate chloride Openeye Name: (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2-methylpropanoate chloride CAS Name: 2-methylpropanoic acid (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) ester chloride IUPAC Name: (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2-methylpropanoate chloride Traditional Name: 2-methylpropionic acid (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) ester chloride Formula: C7H12ClN3O2 MolecularWeight: 205.64208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=N[NH+](C=N1)C.[Cl-]

Isomeric SMILES

CC(C)C(=O)OC1=N[NH+](C=N1)C.[Cl-]

InChI

InChI=1S/C7H11N3O2.ClH/c1-5(2)6(11)12-7-8-4-10(3)9-7;/h4-5H,1-3H3;1H