2-nitro-5-[(3-nitro-4-oxidanyl-phenyl)carbonylamino]benzoic acid

Systemtic Name: 2-nitro-5-[(3-nitro-4-oxidanyl-phenyl)carbonylamino]benzoic acid Openeye Name: 5-[(4-hydroxy-3-nitro-benzoyl)amino]-2-nitro-benzoic acid CAS Name: 5-[[(4-hydroxy-3-nitrophenyl)-oxomethyl]amino]-2-nitrobenzoic acid IUPAC Name: 5-[(4-hydroxy-3-nitrobenzoyl)amino]-2-nitrobenzoic acid Traditional Name: 5-[(4-hydroxy-3-nitro-benzoyl)amino]-2-nitro-benzoic acid Formula: C14H9N3O8 MolecularWeight: 347.23656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-])O

InChI

InChI=1S/C14H9N3O8/c18-12-4-1-7(5-11(12)17(24)25)13(19)15-8-2-3-10(16(22)23)9(6-8)14(20)21/h1-6,18H,(H,15,19)(H,20,21)