(2-bromophenyl) 3,5-dinitrobenzoate

Systemtic Name: (2-bromophenyl) 3,5-dinitrobenzoate Openeye Name: (2-bromophenyl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-bromophenyl) ester IUPAC Name: (2-bromophenyl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-bromophenyl) ester Formula: C13H7BrN2O6 MolecularWeight: 367.10848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7BrN2O6/c14-11-3-1-2-4-12(11)22-13(17)8-5-9(15(18)19)7-10(6-8)16(20)21/h1-7H