2-ethyl-2-nitro-1-phenyl-hexane-1,5-dione

Systemtic Name: 2-ethyl-2-nitro-1-phenyl-hexane-1,5-dione Openeye Name: 2-ethyl-2-nitro-1-phenyl-hexane-1,5-dione CAS Name: 2-ethyl-2-nitro-1-phenylhexane-1,5-dione IUPAC Name: 2-ethyl-2-nitro-1-phenylhexane-1,5-dione Traditional Name: 2-ethyl-2-nitro-1-phenyl-hexane-1,5-dione Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO4/c1-3-14(15(18)19,10-9-11(2)16)13(17)12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3