6-nitro-7-oxidanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 6-nitro-7-oxidanyl-1-benzofuran-2-carboxylic acid Openeye Name: 7-hydroxy-6-nitro-benzofuran-2-carboxylic acid CAS Name: 7-hydroxy-6-nitro-2-benzofurancarboxylic acid IUPAC Name: 7-hydroxy-6-nitro-1-benzofuran-2-carboxylic acid Traditional Name: 7-hydroxy-6-nitro-coumarilic acid Formula: C9H5NO6 MolecularWeight: 223.1391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1C=C(O2)C(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C2=C1C=C(O2)C(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H5NO6/c11-7-5(10(14)15)2-1-4-3-6(9(12)13)16-8(4)7/h1-3,11H,(H,12,13)