[(E)-4-oxidanylidenebut-2-enyl] 4-nitrobenzoate

Systemtic Name: [(E)-4-oxidanylidenebut-2-enyl] 4-nitrobenzoate Openeye Name: [(E)-4-oxobut-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-4-oxobut-2-enyl] ester IUPAC Name: [(E)-4-oxobut-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-4-ketobut-2-enyl] ester Formula: C11H9NO5 MolecularWeight: 235.19286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC=CC=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC/C=C/C=O)[N+](=O)[O-]

InChI

InChI=1S/C11H9NO5/c13-7-1-2-8-17-11(14)9-3-5-10(6-4-9)12(15)16/h1-7H,8H2/b2-1+