methyl 6-nitro-5-oxidanyl-octadecanoate

Systemtic Name: methyl 6-nitro-5-oxidanyl-octadecanoate Openeye Name: methyl 5-hydroxy-6-nitro-octadecanoate CAS Name: 5-hydroxy-6-nitrooctadecanoic acid methyl ester IUPAC Name: methyl 5-hydroxy-6-nitrooctadecanoate Traditional Name: 5-hydroxy-6-nitro-stearic acid methyl ester Formula: C19H37NO5 MolecularWeight: 359.50078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(CCCC(=O)OC)O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC(C(CCCC(=O)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C19H37NO5/c1-3-4-5-6-7-8-9-10-11-12-14-17(20(23)24)18(21)15-13-16-19(22)25-2/h17-18,21H,3-16H2,1-2H3