3-(4-nitrophenyl)carbonylpentane-2,4-dione

Systemtic Name: 3-(4-nitrophenyl)carbonylpentane-2,4-dione Openeye Name: 3-(4-nitrobenzoyl)pentane-2,4-dione CAS Name: 3-[(4-nitrophenyl)-oxomethyl]pentane-2,4-dione IUPAC Name: 3-(4-nitrobenzoyl)pentane-2,4-dione Traditional Name: 3-(4-nitrobenzoyl)pentane-2,4-dione Formula: C12H11NO5 MolecularWeight: 249.21944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO5/c1-7(14)11(8(2)15)12(16)9-3-5-10(6-4-9)13(17)18/h3-6,11H,1-2H3