3,3-dimethyl-6-nitro-heptane-2,5-dione

Systemtic Name: 3,3-dimethyl-6-nitro-heptane-2,5-dione Openeye Name: 3,3-dimethyl-6-nitro-heptane-2,5-dione CAS Name: 3,3-dimethyl-6-nitroheptane-2,5-dione IUPAC Name: 3,3-dimethyl-6-nitroheptane-2,5-dione Traditional Name: 3,3-dimethyl-6-nitro-heptane-2,5-dione Formula: C9H15NO4 MolecularWeight: 201.2197

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO4/c1-6(10(13)14)8(12)5-9(3,4)7(2)11/h6H,5H2,1-4H3