dimethyl 4,4-dinitro-2-oxidanyl-heptanedioate

Systemtic Name: dimethyl 4,4-dinitro-2-oxidanyl-heptanedioate Openeye Name: dimethyl 2-hydroxy-4,4-dinitro-heptanedioate CAS Name: 2-hydroxy-4,4-dinitroheptanedioic acid dimethyl ester IUPAC Name: dimethyl 2-hydroxy-4,4-dinitroheptanedioate Traditional Name: 2-hydroxy-4,4-dinitro-pimelic acid dimethyl ester Formula: C9H14N2O9 MolecularWeight: 294.21546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CC(C(=O)OC)O)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC(CC(C(=O)OC)O)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H14N2O9/c1-19-7(13)3-4-9(10(15)16,11(17)18)5-6(12)8(14)20-2/h6,12H,3-5H2,1-2H3