(2-oxidanylidenecyclohexyl) 2-chloranyl-5-nitro-benzoate

Systemtic Name: (2-oxidanylidenecyclohexyl) 2-chloranyl-5-nitro-benzoate Openeye Name: (2-oxocyclohexyl) 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (2-ketocyclohexyl) ester Formula: C13H12ClNO5 MolecularWeight: 297.69108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClNO5/c14-10-6-5-8(15(18)19)7-9(10)13(17)20-12-4-2-1-3-11(12)16/h5-7,12H,1-4H2