methyl 4-(1H-1,2,4-triazol-5-yl)benzoate

Systemtic Name: methyl 4-(1H-1,2,4-triazol-5-yl)benzoate Openeye Name: methyl 4-(1H-1,2,4-triazol-5-yl)benzoate CAS Name: 4-(1H-1,2,4-triazol-5-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(1H-1,2,4-triazol-5-yl)benzoate Traditional Name: 4-(1H-1,2,4-triazol-5-yl)benzoic acid methyl ester Formula: C10H9N3O2 MolecularWeight: 203.19736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC=NN2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC=NN2

InChI

InChI=1S/C10H9N3O2/c1-15-10(14)8-4-2-7(3-5-8)9-11-6-12-13-9/h2-6H,1H3,(H,11,12,13)