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

Systemtic Name: ethyl 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanoate Openeye Name: ethyl 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)acetic acid ethyl ester IUPAC Name: ethyl 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]acetic acid ethyl ester Formula: C11H12N4O2 MolecularWeight: 232.23858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC(=NN1)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)CC1=NC(=NN1)C2=CC=NC=C2

InChI

InChI=1S/C11H12N4O2/c1-2-17-10(16)7-9-13-11(15-14-9)8-3-5-12-6-4-8/h3-6H,2,7H2,1H3,(H,13,14,15)