[(1S)-2-oxidanylidenecyclohexyl] 2-methoxy-5-nitro-benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-methoxy-5-nitro-benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C14H15NO6 MolecularWeight: 293.272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC2CCCCC2=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O[C@H]2CCCCC2=O

InChI

InChI=1S/C14H15NO6/c1-20-12-7-6-9(15(18)19)8-10(12)14(17)21-13-5-3-2-4-11(13)16/h6-8,13H,2-5H2,1H3/t13-/m0/s1