1-[2-nitro-3,4-bis(oxidanyl)phenyl]propan-2-one

Systemtic Name: 1-[2-nitro-3,4-bis(oxidanyl)phenyl]propan-2-one Openeye Name: 1-(3,4-dihydroxy-2-nitro-phenyl)propan-2-one CAS Name: 1-(3,4-dihydroxy-2-nitrophenyl)-2-propanone IUPAC Name: 1-(3,4-dihydroxy-2-nitrophenyl)propan-2-one Traditional Name: 1-(3,4-dihydroxy-2-nitro-phenyl)acetone Formula: C9H9NO5 MolecularWeight: 211.17146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C(=C(C=C1)O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CC1=C(C(=C(C=C1)O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO5/c1-5(11)4-6-2-3-7(12)9(13)8(6)10(14)15/h2-3,12-13H,4H2,1H3