methyl 3,3-dimethyl-4-nitro-5-oxidanyl-pentanoate

Systemtic Name: methyl 3,3-dimethyl-4-nitro-5-oxidanyl-pentanoate Openeye Name: methyl 5-hydroxy-3,3-dimethyl-4-nitro-pentanoate CAS Name: 5-hydroxy-3,3-dimethyl-4-nitropentanoic acid methyl ester IUPAC Name: methyl 5-hydroxy-3,3-dimethyl-4-nitropentanoate Traditional Name: 5-hydroxy-3,3-dimethyl-4-nitro-valeric acid methyl ester Formula: C8H15NO5 MolecularWeight: 205.2084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO5/c1-8(2,4-7(11)14-3)6(5-10)9(12)13/h6,10H,4-5H2,1-3H3