2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanoate

Systemtic Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanoate Openeye Name: 2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]acetate CAS Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)acetate IUPAC Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)acetate Traditional Name: 2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]acetate Formula: C9H7N4O2- MolecularWeight: 203.17748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=NNC(=N2)CC(=O)[O-]

Isomeric SMILES

C1=CN=CC=C1C2=NNC(=N2)CC(=O)[O-]

InChI

InChI=1S/C9H8N4O2/c14-8(15)5-7-11-9(13-12-7)6-1-3-10-4-2-6/h1-4H,5H2,(H,14,15)(H,11,12,13)/p-1