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

Systemtic Name: 5-nitro-2-(4-nitrophenyl)benzoic acid Openeye Name: 5-nitro-2-(4-nitrophenyl)benzoic acid CAS Name: 5-nitro-2-(4-nitrophenyl)benzoic acid IUPAC Name: 5-nitro-2-(4-nitrophenyl)benzoic acid Traditional Name: 5-nitro-2-(4-nitrophenyl)benzoic acid Formula: C13H8N2O6 MolecularWeight: 288.21242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

InChI

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