(2-oxidanylideneoxolan-3-yl) 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1COC(=O)C1OC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C13H11N3O4/c17-12(20-11-5-6-19-13(11)18)9-1-3-10(4-2-9)16-8-14-7-15-16/h1-4,7-8,11H,5-6H2