6-(hydroxymethyl)-3-[(2-nitrophenyl)methoxy]-4,5-bis(oxidanyl)oxan-2-olate

Systemtic Name: 6-(hydroxymethyl)-3-[(2-nitrophenyl)methoxy]-4,5-bis(oxidanyl)oxan-2-olate Openeye Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-[(2-nitrophenyl)methoxy]tetrahydropyran-2-olate CAS Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-[(2-nitrophenyl)methoxy]-2-oxanolate IUPAC Name: 4,5-dihydroxy-6-(hydroxymethyl)-3-[(2-nitrophenyl)methoxy]oxan-2-olate Traditional Name: 4,5-dihydroxy-6-methylol-3-(2-nitrobenzyl)oxy-tetrahydropyran-2-olate Formula: C13H16NO8- MolecularWeight: 314.26804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2C(C(C(OC2[O-])CO)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC2C(C(C(OC2[O-])CO)O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H16NO8/c15-5-9-10(16)11(17)12(13(18)22-9)21-6-7-3-1-2-4-8(7)14(19)20/h1-4,9-13,15-17H,5-6H2/q-1