methyl 6-nitro-4-oxidanyl-octanoate

Systemtic Name: methyl 6-nitro-4-oxidanyl-octanoate Openeye Name: methyl 4-hydroxy-6-nitro-octanoate CAS Name: 4-hydroxy-6-nitrooctanoic acid methyl ester IUPAC Name: methyl 4-hydroxy-6-nitrooctanoate Traditional Name: 4-hydroxy-6-nitro-caprylic acid methyl ester Formula: C9H17NO5 MolecularWeight: 219.23498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO5/c1-3-7(10(13)14)6-8(11)4-5-9(12)15-2/h7-8,11H,3-6H2,1-2H3