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

Systemtic Name: (5-pyridin-4-yl-1H-1,2,4-triazol-3-yl) propanoate Openeye Name: [5-(4-pyridyl)-1H-1,2,4-triazol-3-yl] propanoate CAS Name: propanoic acid (5-pyridin-4-yl-1H-1,2,4-triazol-3-yl) ester IUPAC Name: (5-pyridin-4-yl-1H-1,2,4-triazol-3-yl) propanoate Traditional Name: propionic acid [5-(4-pyridyl)-1H-1,2,4-triazol-3-yl] ester Formula: C10H10N4O2 MolecularWeight: 218.212

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=NNC(=N1)C2=CC=NC=C2

Isomeric SMILES

CCC(=O)OC1=NNC(=N1)C2=CC=NC=C2

InChI

InChI=1S/C10H10N4O2/c1-2-8(15)16-10-12-9(13-14-10)7-3-5-11-6-4-7/h3-6H,2H2,1H3,(H,12,13,14)