3-nitro-4-(2-nitrophenyl)benzoic acid

Systemtic Name: 3-nitro-4-(2-nitrophenyl)benzoic acid Openeye Name: 3-nitro-4-(2-nitrophenyl)benzoic acid CAS Name: 3-nitro-4-(2-nitrophenyl)benzoic acid IUPAC Name: 3-nitro-4-(2-nitrophenyl)benzoic acid Traditional Name: 3-nitro-4-(2-nitrophenyl)benzoic acid Formula: C13H8N2O6 MolecularWeight: 288.21242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8N2O6/c16-13(17)8-5-6-10(12(7-8)15(20)21)9-3-1-2-4-11(9)14(18)19/h1-7H,(H,16,17)