(1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2,2-dimethylpropanoate dichloride

Systemtic Name: (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2,2-dimethylpropanoate dichloride Openeye Name: (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2,2-dimethylpropanoate dichloride CAS Name: 2,2-dimethylpropanoic acid (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) ester dichloride IUPAC Name: (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) 2,2-dimethylpropanoate dichloride Traditional Name: 2,2-dimethylpropionic acid (1-methyl-1H-1,2,4-triazol-1-ium-3-yl) ester dichloride Formula: C8H14Cl2N3O2- MolecularWeight: 255.12166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13N3O2.2ClH/c1-8(2,3)6(12)13-7-9-5-11(4)10-7;;/h5H,1-4H3;2*1H/p-1