1-[3-nitro-4,5-bis(oxidanyl)phenyl]propan-1-one

Systemtic Name: 1-[3-nitro-4,5-bis(oxidanyl)phenyl]propan-1-one Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)propan-1-one CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-1-propanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)propan-1-one Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)propan-1-one Formula: C9H9NO5 MolecularWeight: 211.17146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO5/c1-2-7(11)5-3-6(10(14)15)9(13)8(12)4-5/h3-4,12-13H,2H2,1H3