2-[2-(3,5-dimethyl-1,2,4-triazol-4-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-(3,5-dimethyl-1,2,4-triazol-4-yl)phenoxy]ethanoic acid Openeye Name: 2-[2-(3,5-dimethyl-1,2,4-triazol-4-yl)phenoxy]acetic acid CAS Name: 2-[2-(3,5-dimethyl-1,2,4-triazol-4-yl)phenoxy]acetic acid IUPAC Name: 2-[2-(3,5-dimethyl-1,2,4-triazol-4-yl)phenoxy]acetic acid Traditional Name: 2-[2-(3,5-dimethyl-1,2,4-triazol-4-yl)phenoxy]acetic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2OCC(=O)O)C

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2OCC(=O)O)C

InChI

InChI=1S/C12H13N3O3/c1-8-13-14-9(2)15(8)10-5-3-4-6-11(10)18-7-12(16)17/h3-6H,7H2,1-2H3,(H,16,17)