2,2,3-trimethyl-3-nitro-1-(4-nitrophenyl)butan-1-one

Systemtic Name: 2,2,3-trimethyl-3-nitro-1-(4-nitrophenyl)butan-1-one Openeye Name: 2,2,3-trimethyl-3-nitro-1-(4-nitrophenyl)butan-1-one CAS Name: 2,2,3-trimethyl-3-nitro-1-(4-nitrophenyl)-1-butanone IUPAC Name: 2,2,3-trimethyl-3-nitro-1-(4-nitrophenyl)butan-1-one Traditional Name: 2,2,3-trimethyl-3-nitro-1-(4-nitrophenyl)butan-1-one Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c1-12(2,13(3,4)15(19)20)11(16)9-5-7-10(8-6-9)14(17)18/h5-8H,1-4H3