[(1S)-2-oxidanylidenecyclohexyl] 4-bromanyl-3-nitro-benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C13H12BrNO5 MolecularWeight: 342.14208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H12BrNO5/c14-9-6-5-8(7-10(9)15(18)19)13(17)20-12-4-2-1-3-11(12)16/h5-7,12H,1-4H2/t12-/m0/s1