methyl 4-nitro-7-oxidanyl-octanoate

Systemtic Name: methyl 4-nitro-7-oxidanyl-octanoate Openeye Name: methyl 7-hydroxy-4-nitro-octanoate CAS Name: 7-hydroxy-4-nitrooctanoic acid methyl ester IUPAC Name: methyl 7-hydroxy-4-nitrooctanoate Traditional Name: 7-hydroxy-4-nitro-caprylic acid methyl ester Formula: C9H17NO5 MolecularWeight: 219.23498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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