methyl 2-(3-phenyl-1H-1,2,4-triazol-5-yl)ethanoate

Systemtic Name: methyl 2-(3-phenyl-1H-1,2,4-triazol-5-yl)ethanoate Openeye Name: methyl 2-(3-phenyl-1H-1,2,4-triazol-5-yl)acetate CAS Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)acetic acid methyl ester IUPAC Name: methyl 2-(3-phenyl-1H-1,2,4-triazol-5-yl)acetate Traditional Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)acetic acid methyl ester Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NC(=NN1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1=NC(=NN1)C2=CC=CC=C2

InChI

InChI=1S/C11H11N3O2/c1-16-10(15)7-9-12-11(14-13-9)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,12,13,14)