3-ethanoyl-4-(3-nitrophenyl)heptane-2,5-dione

Systemtic Name: 3-ethanoyl-4-(3-nitrophenyl)heptane-2,5-dione Openeye Name: 3-acetyl-4-(3-nitrophenyl)heptane-2,5-dione CAS Name: 3-acetyl-4-(3-nitrophenyl)heptane-2,5-dione IUPAC Name: 3-acetyl-4-(3-nitrophenyl)heptane-2,5-dione Traditional Name: 3-acetyl-4-(3-nitrophenyl)heptane-2,5-dione Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO5/c1-4-13(19)15(14(9(2)17)10(3)18)11-6-5-7-12(8-11)16(20)21/h5-8,14-15H,4H2,1-3H3