(4S,5S)-5-(hydroxymethyl)-4-(4-nitropyrazol-1-yl)oxolan-2-one

Systemtic Name: (4S,5S)-5-(hydroxymethyl)-4-(4-nitropyrazol-1-yl)oxolan-2-one Openeye Name: (4S,5S)-5-(hydroxymethyl)-4-(4-nitropyrazol-1-yl)tetrahydrofuran-2-one CAS Name: (4S,5S)-5-(hydroxymethyl)-4-(4-nitro-1-pyrazolyl)-2-oxolanone IUPAC Name: (4S,5S)-5-(hydroxymethyl)-4-(4-nitropyrazol-1-yl)oxolan-2-one Traditional Name: (4S,5S)-5-methylol-4-(4-nitropyrazol-1-yl)tetrahydrofuran-2-one Formula: C8H9N3O5 MolecularWeight: 227.17416

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1=O)CO)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H]([C@H](OC1=O)CO)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C8H9N3O5/c12-4-7-6(1-8(13)16-7)10-3-5(2-9-10)11(14)15/h2-3,6-7,12H,1,4H2/t6-,7+/m0/s1