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

Systemtic Name: 1-[2-(2-methylphenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(2-methylphenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(2-methylphenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(2-methylphenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(2-methylphenoxy)ethyl]triazole-4-carboxylic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCN2C=C(N=N2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1OCCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C12H13N3O3/c1-9-4-2-3-5-11(9)18-7-6-15-8-10(12(16)17)13-14-15/h2-5,8H,6-7H2,1H3,(H,16,17)