1-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-phenoxy-ethanone

Systemtic Name: 1-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-phenoxy-ethanone Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-phenoxy-ethanone CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-phenoxyethanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-phenoxyethanone Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-phenoxy-ethanone Formula: C14H11NO6 MolecularWeight: 289.24024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO6/c16-12-7-9(6-11(14(12)18)15(19)20)13(17)8-21-10-4-2-1-3-5-10/h1-7,16,18H,8H2