1-[2-(3-cyanophenoxy)ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-(3-cyanophenoxy)ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-(3-cyanophenoxy)ethyl]triazole-4-carboxylate CAS Name: 1-[2-(3-cyanophenoxy)ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-(3-cyanophenoxy)ethyl]triazole-4-carboxylate Traditional Name: 1-[2-(3-cyanophenoxy)ethyl]triazole-4-carboxylate Formula: C12H9N4O3- MolecularWeight: 257.22486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCN2C=C(N=N2)C(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)OCCN2C=C(N=N2)C(=O)[O-])C#N

InChI

InChI=1S/C12H10N4O3/c13-7-9-2-1-3-10(6-9)19-5-4-16-8-11(12(17)18)14-15-16/h1-3,6,8H,4-5H2,(H,17,18)/p-1