methyl (1S,5S,6R)-5-acetyloxy-6-nitro-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1S,5S,6R)-5-acetyloxy-6-nitro-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1S,5S,6R)-5-acetoxy-6-nitro-cyclohex-3-ene-1-carboxylate CAS Name: (1S,5S,6R)-5-acetyloxy-6-nitro-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,5S,6R)-5-acetyloxy-6-nitrocyclohex-3-ene-1-carboxylate Traditional Name: (1S,5S,6R)-5-acetoxy-6-nitro-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C10H13NO6 MolecularWeight: 243.21332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CCC(C1[N+](=O)[O-])C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO6/c1-6(12)17-8-5-3-4-7(10(13)16-2)9(8)11(14)15/h3,5,7-9H,4H2,1-2H3/t7-,8-,9+/m0/s1