ethyl 2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]ethanoate

Systemtic Name: ethyl 2-[3-(5-bromanylpyridin-3-yl)-1H-1,2,4-triazol-5-yl]ethanoate Openeye Name: ethyl 2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]acetate CAS Name: 2-[3-(5-bromo-3-pyridinyl)-1H-1,2,4-triazol-5-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]acetate Traditional Name: 2-[3-(5-bromo-3-pyridyl)-1H-1,2,4-triazol-5-yl]acetic acid ethyl ester Formula: C11H11BrN4O2 MolecularWeight: 311.13464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrN4O2/c1-2-18-10(17)4-9-14-11(16-15-9)7-3-8(12)6-13-5-7/h3,5-6H,2,4H2,1H3,(H,14,15,16)