(2-oxidanylidenecyclohexyl) 4-nitrobenzenesulfonate

Systemtic Name: (2-oxidanylidenecyclohexyl) 4-nitrobenzenesulfonate Openeye Name: (2-oxocyclohexyl) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (2-ketocyclohexyl) ester Formula: C12H13NO6S MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=O)C(C1)OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO6S/c14-11-3-1-2-4-12(11)19-20(17,18)10-7-5-9(6-8-10)13(15)16/h5-8,12H,1-4H2