3-[(4-bromanyl-3-nitro-phenyl)carbonylamino]benzoic acid

Systemtic Name: 3-[(4-bromanyl-3-nitro-phenyl)carbonylamino]benzoic acid Openeye Name: 3-[(4-bromo-3-nitro-benzoyl)amino]benzoic acid CAS Name: 3-[[(4-bromo-3-nitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(4-bromo-3-nitrobenzoyl)amino]benzoic acid Traditional Name: 3-[(4-bromo-3-nitro-benzoyl)amino]benzoic acid Formula: C14H9BrN2O5 MolecularWeight: 365.13566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9BrN2O5/c15-11-5-4-8(7-12(11)17(21)22)13(18)16-10-3-1-2-9(6-10)14(19)20/h1-7H,(H,16,18)(H,19,20)