methyl 6-nitro-4-oxidanylidene-octanoate

Systemtic Name: methyl 6-nitro-4-oxidanylidene-octanoate Openeye Name: methyl 6-nitro-4-oxo-octanoate CAS Name: 6-nitro-4-oxooctanoic acid methyl ester IUPAC Name: methyl 6-nitro-4-oxooctanoate Traditional Name: 4-keto-6-nitro-caprylic acid methyl ester Formula: C9H15NO5 MolecularWeight: 217.2191

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO5/c1-3-7(10(13)14)6-8(11)4-5-9(12)15-2/h7H,3-6H2,1-2H3