3,4-bis(2,2-dinitropropyl)azete-2-carbaldehyde

Systemtic Name: 3,4-bis(2,2-dinitropropyl)azete-2-carbaldehyde Openeye Name: 3,4-bis(2,2-dinitropropyl)azete-2-carbaldehyde CAS Name: 3,4-bis(2,2-dinitropropyl)-2-azetecarboxaldehyde IUPAC Name: 3,4-bis(2,2-dinitropropyl)azete-2-carbaldehyde Traditional Name: 3,4-bis(2,2-dinitropropyl)azete-2-carbaldehyde Formula: C10H11N5O9 MolecularWeight: 345.22244

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(N=C1CC(C)([N+](=O)[O-])[N+](=O)[O-])C=O)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CC1=C(N=C1CC(C)([N+](=O)[O-])[N+](=O)[O-])C=O)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H11N5O9/c1-9(12(17)18,13(19)20)3-6-7(11-8(6)5-16)4-10(2,14(21)22)15(23)24/h5H,3-4H2,1-2H3