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

Systemtic Name: ethyl 2-(3-phenyl-1H-1,2,4-triazol-5-yl)ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O2/c1-2-17-11(16)8-10-13-12(15-14-10)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,14,15)