5-bromanyl-2-[(3,5-dinitrophenyl)carbonylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[(3,5-dinitrophenyl)carbonylamino]benzoic acid Openeye Name: 5-bromo-2-[(3,5-dinitrobenzoyl)amino]benzoic acid CAS Name: 5-bromo-2-[[(3,5-dinitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[(3,5-dinitrobenzoyl)amino]benzoic acid Traditional Name: 5-bromo-2-[(3,5-dinitrobenzoyl)amino]benzoic acid Formula: C14H8BrN3O7 MolecularWeight: 410.13322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8BrN3O7/c15-8-1-2-12(11(5-8)14(20)21)16-13(19)7-3-9(17(22)23)6-10(4-7)18(24)25/h1-6H,(H,16,19)(H,20,21)