[(1S,2R,3S)-3-methanoyl-2-nitro-cyclohexyl] ethanoate

Systemtic Name: [(1S,2R,3S)-3-methanoyl-2-nitro-cyclohexyl] ethanoate Openeye Name: [(1S,2R,3S)-3-formyl-2-nitro-cyclohexyl] acetate CAS Name: acetic acid [(1S,2R,3S)-3-formyl-2-nitrocyclohexyl] ester IUPAC Name: [(1S,2R,3S)-3-formyl-2-nitrocyclohexyl] acetate Traditional Name: acetic acid [(1S,2R,3S)-3-formyl-2-nitro-cyclohexyl] ester Formula: C9H13NO5 MolecularWeight: 215.20322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCC(C1[N+](=O)[O-])C=O

Isomeric SMILES

CC(=O)O[C@H]1CCC[C@@H]([C@H]1[N+](=O)[O-])C=O

InChI

InChI=1S/C9H13NO5/c1-6(12)15-8-4-2-3-7(5-11)9(8)10(13)14/h5,7-9H,2-4H2,1H3/t7-,8+,9-/m1/s1