2-methyl-2-(1,2,4-triazol-1-yl)propanoate

Systemtic Name: 2-methyl-2-(1,2,4-triazol-1-yl)propanoate Openeye Name: 2-methyl-2-(1,2,4-triazol-1-yl)propanoate CAS Name: 2-methyl-2-(1,2,4-triazol-1-yl)propanoate IUPAC Name: 2-methyl-2-(1,2,4-triazol-1-yl)propanoate Traditional Name: 2-methyl-2-(1,2,4-triazol-1-yl)propionate Formula: C6H8N3O2- MolecularWeight: 154.14662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[O-])N1C=NC=N1

Isomeric SMILES

CC(C)(C(=O)[O-])N1C=NC=N1

InChI

InChI=1S/C6H9N3O2/c1-6(2,5(10)11)9-4-7-3-8-9/h3-4H,1-2H3,(H,10,11)/p-1