5,5-dinitro-1,3-bis(3,3,3-trinitropropyl)-1,3-diazinane

Systemtic Name: 5,5-dinitro-1,3-bis(3,3,3-trinitropropyl)-1,3-diazinane Openeye Name: 5,5-dinitro-1,3-bis(3,3,3-trinitropropyl)hexahydropyrimidine CAS Name: 5,5-dinitro-1,3-bis(3,3,3-trinitropropyl)-1,3-diazinane IUPAC Name: 5,5-dinitro-1,3-bis(3,3,3-trinitropropyl)-1,3-diazinane Traditional Name: 5,5-dinitro-1,3-bis(3,3,3-trinitropropyl)hexahydropyrimidine Formula: C10H14N10O16 MolecularWeight: 530.27556

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CN1CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C(CN(CN1CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H14N10O16/c21-13(22)8(14(23)24)5-11(3-1-9(15(25)26,16(27)28)17(29)30)7-12(6-8)4-2-10(18(31)32,19(33)34)20(35)36/h1-7H2