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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NNC(=N2)CC(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NNC(=N2)CC(=O)O

InChI

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