(E)-6-(3-nitro-4-oxidanyl-phenyl)hex-5-ene-2,4-dione

Systemtic Name: (E)-6-(3-nitro-4-oxidanyl-phenyl)hex-5-ene-2,4-dione Openeye Name: (E)-6-(4-hydroxy-3-nitro-phenyl)hex-5-ene-2,4-dione CAS Name: (E)-6-(4-hydroxy-3-nitrophenyl)-5-hexene-2,4-dione IUPAC Name: (E)-6-(4-hydroxy-3-nitrophenyl)hex-5-ene-2,4-dione Traditional Name: (E)-6-(4-hydroxy-3-nitro-phenyl)hex-5-ene-2,4-dione Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO5/c1-8(14)6-10(15)4-2-9-3-5-12(16)11(7-9)13(17)18/h2-5,7,16H,6H2,1H3/b4-2+