(3-oxidanylidenecyclohexen-1-yl) 2-nitrobenzoate

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 2-nitrobenzoate Openeye Name: (3-oxocyclohexen-1-yl) 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid (3-ketocyclohexen-1-yl) ester Formula: C13H11NO5 MolecularWeight: 261.23014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CC(=CC(=O)C1)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H11NO5/c15-9-4-3-5-10(8-9)19-13(16)11-6-1-2-7-12(11)14(17)18/h1-2,6-8H,3-5H2