1-(2-octan-2-yloxyethyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-octan-2-yloxyethyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(1-methylheptoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-(2-octan-2-yloxyethyl)-4-triazolecarboxylic acid IUPAC Name: 1-(2-octan-2-yloxyethyl)triazole-4-carboxylic acid Traditional Name: 1-[2-(1-methylheptoxy)ethyl]triazole-4-carboxylic acid Formula: C13H23N3O3 MolecularWeight: 269.34002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCCN1C=C(N=N1)C(=O)O

Isomeric SMILES

CCCCCCC(C)OCCN1C=C(N=N1)C(=O)O

InChI

InChI=1S/C13H23N3O3/c1-3-4-5-6-7-11(2)19-9-8-16-10-12(13(17)18)14-15-16/h10-11H,3-9H2,1-2H3,(H,17,18)