1-[2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-(5-bromo-2-oxo-1-pyridyl)ethyl]triazole-4-carboxylate CAS Name: 1-[2-(5-bromo-2-oxo-1-pyridinyl)ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-(5-bromo-2-oxopyridin-1-yl)ethyl]triazole-4-carboxylate Traditional Name: 1-[2-(5-bromo-2-keto-1-pyridyl)ethyl]triazole-4-carboxylate Formula: C10H8BrN4O3- MolecularWeight: 312.09952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C=C1Br)CCN2C=C(N=N2)C(=O)[O-]

Isomeric SMILES

C1=CC(=O)N(C=C1Br)CCN2C=C(N=N2)C(=O)[O-]

InChI

InChI=1S/C10H9BrN4O3/c11-7-1-2-9(16)14(5-7)3-4-15-6-8(10(17)18)12-13-15/h1-2,5-6H,3-4H2,(H,17,18)/p-1