(4-bromanyl-2-chloranyl-phenyl) 3,5-dinitrobenzoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 3,5-dinitrobenzoate Openeye Name: (4-bromo-2-chloro-phenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (4-bromo-2-chloro-phenyl) ester Formula: C13H6BrClN2O6 MolecularWeight: 401.55354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H6BrClN2O6/c14-8-1-2-12(11(15)5-8)23-13(18)7-3-9(16(19)20)6-10(4-7)17(21)22/h1-6H