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

Systemtic Name: 3-(4-nitrophenoxy)-4,5-bis(oxidanyl)-6-(phosphonooxymethyl)oxan-2-olate Openeye Name: 4,5-dihydroxy-3-(4-nitrophenoxy)-6-(phosphonooxymethyl)tetrahydropyran-2-olate CAS Name: 4,5-dihydroxy-3-(4-nitrophenoxy)-6-(phosphonooxymethyl)-2-oxanolate IUPAC Name: 4,5-dihydroxy-3-(4-nitrophenoxy)-6-(phosphonooxymethyl)oxan-2-olate Traditional Name: 4,5-dihydroxy-3-(4-nitrophenoxy)-6-(phosphonooxymethyl)tetrahydropyran-2-olate Formula: C12H15NO11P- MolecularWeight: 380.221361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC2C(C(C(OC2[O-])COP(=O)(O)O)O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC2C(C(C(OC2[O-])COP(=O)(O)O)O)O

InChI

InChI=1S/C12H15NO11P/c14-9-8(5-22-25(19,20)21)24-12(16)11(10(9)15)23-7-3-1-6(2-4-7)13(17)18/h1-4,8-12,14-15H,5H2,(H2,19,20,21)/q-1