(4-bromanyl-3-fluoranyl-phenyl) 4-nitrobenzoate

Systemtic Name: (4-bromanyl-3-fluoranyl-phenyl) 4-nitrobenzoate Openeye Name: (4-bromo-3-fluoro-phenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (4-bromo-3-fluorophenyl) ester IUPAC Name: (4-bromo-3-fluorophenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4-bromo-3-fluoro-phenyl) ester Formula: C13H7BrFNO4 MolecularWeight: 340.101383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=CC(=C(C=C2)Br)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=CC(=C(C=C2)Br)F)[N+](=O)[O-]

InChI

InChI=1S/C13H7BrFNO4/c14-11-6-5-10(7-12(11)15)20-13(17)8-1-3-9(4-2-8)16(18)19/h1-7H