ethyl 4,4-dinitropentanoate

Systemtic Name: ethyl 4,4-dinitropentanoate Openeye Name: ethyl 4,4-dinitropentanoate CAS Name: 4,4-dinitropentanoic acid ethyl ester IUPAC Name: ethyl 4,4-dinitropentanoate Traditional Name: 4,4-dinitrovaleric acid ethyl ester Formula: C7H12N2O6 MolecularWeight: 220.17998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCC(C)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H12N2O6/c1-3-15-6(10)4-5-7(2,8(11)12)9(13)14/h3-5H2,1-2H3