(4-ethanoylphenyl) 4-bromanyl-3-nitro-benzoate

Systemtic Name: (4-ethanoylphenyl) 4-bromanyl-3-nitro-benzoate Openeye Name: (4-acetylphenyl) 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid (4-acetylphenyl) ester Formula: C15H10BrNO5 MolecularWeight: 364.1476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10BrNO5/c1-9(18)10-2-5-12(6-3-10)22-15(19)11-4-7-13(16)14(8-11)17(20)21/h2-8H,1H3