[(3S)-2-oxidanylideneoxolan-3-yl] 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C12H10N4O4 MolecularWeight: 274.2322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1COC(=O)[C@H]1OC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C12H10N4O4/c17-11(20-10-5-6-19-12(10)18)8-1-3-9(4-2-8)16-7-13-14-15-16/h1-4,7,10H,5-6H2/t10-/m0/s1