3,7-dinitro-5,5-bis(2-nitro-3-oxidanylidene-butanoyl)nonane-2,4,6,8-tetrone

Systemtic Name: 3,7-dinitro-5,5-bis(2-nitro-3-oxidanylidene-butanoyl)nonane-2,4,6,8-tetrone Openeye Name: 3,7-dinitro-5,5-bis(2-nitro-3-oxo-butanoyl)nonane-2,4,6,8-tetrone CAS Name: 3,7-dinitro-5,5-bis(2-nitro-1,3-dioxobutyl)nonane-2,4,6,8-tetrone IUPAC Name: 3,7-dinitro-5,5-bis(2-nitro-3-oxobutanoyl)nonane-2,4,6,8-tetrone Traditional Name: 5,5-bis(3-keto-2-nitro-butanoyl)-3,7-dinitro-nonane-2,4,6,8-tetrone Formula: C17H16N4O16 MolecularWeight: 532.32614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O16/c1-5(22)9(18(30)31)13(26)17(14(27)10(6(2)23)19(32)33,15(28)11(7(3)24)20(34)35)16(29)12(8(4)25)21(36)37/h9-12H,1-4H3