(3-nitrophenyl) 4-nitro-2-oxidanyl-benzoate

Systemtic Name: (3-nitrophenyl) 4-nitro-2-oxidanyl-benzoate Openeye Name: (3-nitrophenyl) 2-hydroxy-4-nitro-benzoate CAS Name: 2-hydroxy-4-nitrobenzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 2-hydroxy-4-nitrobenzoate Traditional Name: 2-hydroxy-4-nitro-benzoic acid (3-nitrophenyl) ester Formula: C13H8N2O7 MolecularWeight: 304.21182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8N2O7/c16-12-7-9(15(20)21)4-5-11(12)13(17)22-10-3-1-2-8(6-10)14(18)19/h1-7,16H