methyl 4-nitro-7-oxidanylidene-octanoate

Systemtic Name: methyl 4-nitro-7-oxidanylidene-octanoate Openeye Name: methyl 4-nitro-7-oxo-octanoate CAS Name: 4-nitro-7-oxooctanoic acid methyl ester IUPAC Name: methyl 4-nitro-7-oxooctanoate Traditional Name: 7-keto-4-nitro-caprylic acid methyl ester Formula: C9H15NO5 MolecularWeight: 217.2191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO5/c1-7(11)3-4-8(10(13)14)5-6-9(12)15-2/h8H,3-6H2,1-2H3