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

Systemtic Name: 1-[2-(3-ethylphenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(3-ethylphenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(3-ethylphenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(3-ethylphenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(3-ethylphenoxy)ethyl]triazole-4-carboxylic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCCN2C=C(N=N2)C(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)OCCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C13H15N3O3/c1-2-10-4-3-5-11(8-10)19-7-6-16-9-12(13(17)18)14-15-16/h3-5,8-9H,2,6-7H2,1H3,(H,17,18)