dimethyl 4,4-dinitroheptanedioate

Systemtic Name: dimethyl 4,4-dinitroheptanedioate Openeye Name: dimethyl 4,4-dinitroheptanedioate CAS Name: 4,4-dinitroheptanedioic acid dimethyl ester IUPAC Name: dimethyl 4,4-dinitroheptanedioate Traditional Name: 4,4-dinitropimelic acid dimethyl ester Formula: C9H14N2O8 MolecularWeight: 278.21606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14N2O8/c1-18-7(12)3-5-9(10(14)15,11(16)17)6-4-8(13)19-2/h3-6H2,1-2H3