3-acetamido-6-(hydroxymethyl)-3-(4-nitrophenoxy)-4,5-bis(oxidanyl)oxan-2-olate

Systemtic Name: 3-acetamido-6-(hydroxymethyl)-3-(4-nitrophenoxy)-4,5-bis(oxidanyl)oxan-2-olate Openeye Name: 3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-3-(4-nitrophenoxy)tetrahydropyran-2-olate CAS Name: 3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-3-(4-nitrophenoxy)-2-oxanolate IUPAC Name: 3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-3-(4-nitrophenoxy)oxan-2-olate Traditional Name: 3-acetamido-4,5-dihydroxy-6-methylol-3-(4-nitrophenoxy)tetrahydropyran-2-olate Formula: C14H17N2O9- MolecularWeight: 357.29278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C(C(C(OC1[O-])CO)O)O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1(C(C(C(OC1[O-])CO)O)O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N2O9/c1-7(18)15-14(12(20)11(19)10(6-17)24-13(14)21)25-9-4-2-8(3-5-9)16(22)23/h2-5,10-13,17,19-20H,6H2,1H3,(H,15,18)/q-1