7-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4-oxidanylidene-pyrrolo[2,3-d][1,3]oxazine-5-carboxylic acid

Systemtic Name: 7-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-4-oxidanylidene-pyrrolo[2,3-d][1,3]oxazine-5-carboxylic acid Openeye Name: 7-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-oxo-pyrrolo[2,3-d][1,3]oxazine-5-carboxylic acid CAS Name: 7-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-oxo-5-pyrrolo[2,3-d][1,3]oxazinecarboxylic acid IUPAC Name: 7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxopyrrolo[2,3-d][1,3]oxazine-5-carboxylic acid Traditional Name: 7-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-4-keto-pyrrolo[2,3-d][1,3]oxazine-5-carboxylic acid Formula: C12H12N2O8 MolecularWeight: 312.23228

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=C(N1C3C(C(C(O3)CO)O)O)N=COC2=O)C(=O)O

Isomeric SMILES

C1=C(C2=C(N1C3C(C(C(O3)CO)O)O)N=COC2=O)C(=O)O

InChI

InChI=1S/C12H12N2O8/c15-2-5-7(16)8(17)10(22-5)14-1-4(11(18)19)6-9(14)13-3-21-12(6)20/h1,3,5,7-8,10,15-17H,2H2,(H,18,19)