2-[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]ethanoic acid

Systemtic Name: 2-[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]ethanoic acid Openeye Name: 2-[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]acetic acid CAS Name: 2-[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]acetic acid IUPAC Name: 2-[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]acetic acid Traditional Name: 2-[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]acetic acid Formula: C11H11N3O3 MolecularWeight: 233.22334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NC(=NN2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NC(=NN2)CC(=O)O

InChI

InChI=1S/C11H11N3O3/c15-11(16)6-9-12-10(14-13-9)7-17-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16)(H,12,13,14)