methyl 5-methyl-4-nitro-7-oxidanylidene-octanoate

Systemtic Name: methyl 5-methyl-4-nitro-7-oxidanylidene-octanoate Openeye Name: methyl 5-methyl-4-nitro-7-oxo-octanoate CAS Name: 5-methyl-4-nitro-7-oxooctanoic acid methyl ester IUPAC Name: methyl 5-methyl-4-nitro-7-oxooctanoate Traditional Name: 7-keto-5-methyl-4-nitro-caprylic acid methyl ester Formula: C10H17NO5 MolecularWeight: 231.24568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO5/c1-7(6-8(2)12)9(11(14)15)4-5-10(13)16-3/h7,9H,4-6H2,1-3H3