1-(2-nitrophenyl)hexane-1,3,5-trione

Systemtic Name: 1-(2-nitrophenyl)hexane-1,3,5-trione Openeye Name: 1-(2-nitrophenyl)hexane-1,3,5-trione CAS Name: 1-(2-nitrophenyl)hexane-1,3,5-trione IUPAC Name: 1-(2-nitrophenyl)hexane-1,3,5-trione Traditional Name: 1-(2-nitrophenyl)hexane-1,3,5-trione Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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