3-ethanoyl-1-(2-nitrophenyl)pentane-2,4-dione

Systemtic Name: 3-ethanoyl-1-(2-nitrophenyl)pentane-2,4-dione Openeye Name: 3-acetyl-1-(2-nitrophenyl)pentane-2,4-dione CAS Name: 3-acetyl-1-(2-nitrophenyl)pentane-2,4-dione IUPAC Name: 3-acetyl-1-(2-nitrophenyl)pentane-2,4-dione Traditional Name: 3-acetyl-1-(2-nitrophenyl)pentane-2,4-dione Formula: C13H13NO5 MolecularWeight: 263.24602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO5/c1-8(15)13(9(2)16)12(17)7-10-5-3-4-6-11(10)14(18)19/h3-6,13H,7H2,1-2H3