1-(2,5-dinitrophenyl)-2-methyl-hexan-1-one

Systemtic Name: 1-(2,5-dinitrophenyl)-2-methyl-hexan-1-one Openeye Name: 1-(2,5-dinitrophenyl)-2-methyl-hexan-1-one CAS Name: 1-(2,5-dinitrophenyl)-2-methyl-1-hexanone IUPAC Name: 1-(2,5-dinitrophenyl)-2-methylhexan-1-one Traditional Name: 1-(2,5-dinitrophenyl)-2-methyl-hexan-1-one Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c1-3-4-5-9(2)13(16)11-8-10(14(17)18)6-7-12(11)15(19)20/h6-9H,3-5H2,1-2H3