6-methoxy-3-nitro-2-(1-oxidanylpyrrolidin-1-ium-1-yl)pyridine; oxetan-2-one

Systemtic Name: 6-methoxy-3-nitro-2-(1-oxidanylpyrrolidin-1-ium-1-yl)pyridine; oxetan-2-one Openeye Name: 2-(1-hydroxypyrrolidin-1-ium-1-yl)-6-methoxy-3-nitro-pyridine; oxetan-2-one CAS Name: 2-(1-hydroxy-1-pyrrolidin-1-iumyl)-6-methoxy-3-nitropyridine; 2-oxetanone IUPAC Name: 2-(1-hydroxypyrrolidin-1-ium-1-yl)-6-methoxy-3-nitropyridine; oxetan-2-one Traditional Name: 2-(1-hydroxypyrrolidin-1-ium-1-yl)-6-methoxy-3-nitro-pyridine; oxetan-2-one Formula: C13H18N3O6+ MolecularWeight: 312.29852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)[N+](=O)[O-])[N+]2(CCCC2)O.C1COC1=O

Isomeric SMILES

COC1=NC(=C(C=C1)[N+](=O)[O-])[N+]2(CCCC2)O.C1COC1=O

InChI

InChI=1S/C10H14N3O4.C3H4O2/c1-17-9-5-4-8(12(14)15)10(11-9)13(16)6-2-3-7-13;4-3-1-2-5-3/h4-5,16H,2-3,6-7H2,1H3;1-2H2/q+1;