2-[[4-nitro-2,3-bis(oxidanyl)phenyl]methyl]pyran-4-one

Systemtic Name: 2-[[4-nitro-2,3-bis(oxidanyl)phenyl]methyl]pyran-4-one Openeye Name: 2-[(2,3-dihydroxy-4-nitro-phenyl)methyl]pyran-4-one CAS Name: 2-[(2,3-dihydroxy-4-nitrophenyl)methyl]-4-pyranone IUPAC Name: 2-[(2,3-dihydroxy-4-nitrophenyl)methyl]pyran-4-one Traditional Name: 2-(2,3-dihydroxy-4-nitro-benzyl)pyran-4-one Formula: C12H9NO6 MolecularWeight: 263.20296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1CC2=CC(=O)C=CO2)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1CC2=CC(=O)C=CO2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO6/c14-8-3-4-19-9(6-8)5-7-1-2-10(13(17)18)12(16)11(7)15/h1-4,6,15-16H,5H2