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

Systemtic Name: 1-[2-(4-chloranyl-3-ethyl-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(4-chloro-3-ethyl-phenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(4-chloro-3-ethylphenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(4-chloro-3-ethylphenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(4-chloro-3-ethyl-phenoxy)ethyl]triazole-4-carboxylic acid Formula: C13H14ClN3O3 MolecularWeight: 295.72156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClN3O3/c1-2-9-7-10(3-4-11(9)14)20-6-5-17-8-12(13(18)19)15-16-17/h3-4,7-8H,2,5-6H2,1H3,(H,18,19)