1-[2-(2,4,6-trimethylphenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(2,4,6-trimethylphenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(2,4,6-trimethylphenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(2,4,6-trimethylphenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(2,4,6-trimethylphenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(2,4,6-trimethylphenoxy)ethyl]triazole-4-carboxylic acid Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCCN2C=C(N=N2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCCN2C=C(N=N2)C(=O)O)C

InChI

InChI=1S/C14H17N3O3/c1-9-6-10(2)13(11(3)7-9)20-5-4-17-8-12(14(18)19)15-16-17/h6-8H,4-5H2,1-3H3,(H,18,19)