4-cyano-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1H-imidazol-1-ium-5-olate

Systemtic Name: 4-cyano-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1H-imidazol-1-ium-5-olate Openeye Name: 4-cyano-1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-imidazol-1-ium-5-olate CAS Name: 4-cyano-1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-1H-imidazol-1-ium-5-olate IUPAC Name: 4-cyano-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-imidazol-1-ium-5-olate Traditional Name: 4-cyano-1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-1H-imidazol-1-ium-5-olate Formula: C9H11N3O5 MolecularWeight: 241.20074

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C([NH+]1C2C(C(C(O2)CO)O)O)[O-])C#N

Isomeric SMILES

C1=NC(=C([NH+]1C2C(C(C(O2)CO)O)O)[O-])C#N

InChI

InChI=1S/C9H11N3O5/c10-1-4-8(16)12(3-11-4)9-7(15)6(14)5(2-13)17-9/h3,5-7,9,13-16H,2H2