ethyl 4-(1,2,4-triazol-4-yl)benzoate

Systemtic Name: ethyl 4-(1,2,4-triazol-4-yl)benzoate Openeye Name: ethyl 4-(1,2,4-triazol-4-yl)benzoate CAS Name: 4-(1,2,4-triazol-4-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(1,2,4-triazol-4-yl)benzoate Traditional Name: 4-(1,2,4-triazol-4-yl)benzoic acid ethyl ester Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=NN=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=NN=C2

InChI

InChI=1S/C11H11N3O2/c1-2-16-11(15)9-3-5-10(6-4-9)14-7-12-13-8-14/h3-8H,2H2,1H3