(3S,4R,5S)-4-methoxy-3-methyl-3-nitro-5-oxidanyl-hexanal

Systemtic Name: (3S,4R,5S)-4-methoxy-3-methyl-3-nitro-5-oxidanyl-hexanal Openeye Name: (3S,4R,5S)-5-hydroxy-4-methoxy-3-methyl-3-nitro-hexanal CAS Name: (3S,4R,5S)-5-hydroxy-4-methoxy-3-methyl-3-nitrohexanal IUPAC Name: (3S,4R,5S)-5-hydroxy-4-methoxy-3-methyl-3-nitrohexanal Traditional Name: (3S,4R,5S)-5-hydroxy-4-methoxy-3-methyl-3-nitro-hexanal Formula: C8H15NO5 MolecularWeight: 205.2084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO5/c1-6(11)7(14-3)8(2,4-5-10)9(12)13/h5-7,11H,4H2,1-3H3/t6-,7-,8-/m0/s1