1-[2-(3-pyridin-4-ylpropoxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(3-pyridin-4-ylpropoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-[3-(4-pyridyl)propoxy]ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(3-pyridin-4-ylpropoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(3-pyridin-4-ylpropoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-[3-(4-pyridyl)propoxy]ethyl]triazole-4-carboxylic acid Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CCCOCCN2C=C(N=N2)C(=O)O

Isomeric SMILES

C1=CN=CC=C1CCCOCCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C13H16N4O3/c18-13(19)12-10-17(16-15-12)7-9-20-8-1-2-11-3-5-14-6-4-11/h3-6,10H,1-2,7-9H2,(H,18,19)