(3-nitrophenyl) 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: (3-nitrophenyl) 5-bromanyl-2-chloranyl-benzoate Openeye Name: (3-nitrophenyl) 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid (3-nitrophenyl) ester Formula: C13H7BrClNO4 MolecularWeight: 356.55598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7BrClNO4/c14-8-4-5-12(15)11(6-8)13(17)20-10-3-1-2-9(7-10)16(18)19/h1-7H