3-nitro-4-[(4-nitrophenyl)carbonylamino]benzoic acid

Systemtic Name: 3-nitro-4-[(4-nitrophenyl)carbonylamino]benzoic acid Openeye Name: 3-nitro-4-[(4-nitrobenzoyl)amino]benzoic acid CAS Name: 3-nitro-4-[[(4-nitrophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-nitro-4-[(4-nitrobenzoyl)amino]benzoic acid Traditional Name: 3-nitro-4-[(4-nitrobenzoyl)amino]benzoic acid Formula: C14H9N3O7 MolecularWeight: 331.23716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9N3O7/c18-13(8-1-4-10(5-2-8)16(21)22)15-11-6-3-9(14(19)20)7-12(11)17(23)24/h1-7H,(H,15,18)(H,19,20)