1-[2-(1,3-benzodioxol-5-yloxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(1,3-benzodioxol-5-yloxy)ethyl]triazole-4-carboxylic acid Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCCN3C=C(N=N3)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCCN3C=C(N=N3)C(=O)O

InChI

InChI=1S/C12H11N3O5/c16-12(17)9-6-15(14-13-9)3-4-18-8-1-2-10-11(5-8)20-7-19-10/h1-2,5-6H,3-4,7H2,(H,16,17)