1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-nitro-pyrimidine-2,4-dione

Systemtic Name: 1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-nitro-pyrimidine-2,4-dione Openeye Name: 1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-nitro-pyrimidine-2,4-dione CAS Name: 1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-nitropyrimidine-2,4-dione IUPAC Name: 1-[(2S,5R)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-5-nitropyrimidine-2,4-dione Traditional Name: 1-[(2S,5R)-2-methylol-1,3-oxathiolan-5-yl]-5-nitro-pyrimidine-2,4-quinone Formula: C8H9N3O6S MolecularWeight: 275.23856

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(S1)CO)N2C=C(C(=O)NC2=O)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](O[C@@H](S1)CO)N2C=C(C(=O)NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C8H9N3O6S/c12-2-6-17-5(3-18-6)10-1-4(11(15)16)7(13)9-8(10)14/h1,5-6,12H,2-3H2,(H,9,13,14)/t5-,6+/m1/s1