1-(4-nitrophenyl)-2-(phenylcarbonyl)butane-1,3-dione

Systemtic Name: 1-(4-nitrophenyl)-2-(phenylcarbonyl)butane-1,3-dione Openeye Name: 2-benzoyl-1-(4-nitrophenyl)butane-1,3-dione CAS Name: 2-benzoyl-1-(4-nitrophenyl)butane-1,3-dione IUPAC Name: 2-benzoyl-1-(4-nitrophenyl)butane-1,3-dione Traditional Name: 2-benzoyl-1-(4-nitrophenyl)butane-1,3-dione Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO5/c1-11(19)15(16(20)12-5-3-2-4-6-12)17(21)13-7-9-14(10-8-13)18(22)23/h2-10,15H,1H3