5-acetamido-2-nitro-benzenesulfonic acid

Systemtic Name: 5-acetamido-2-nitro-benzenesulfonic acid Openeye Name: 5-acetamido-2-nitro-benzenesulfonic acid CAS Name: 5-acetamido-2-nitrobenzenesulfonic acid IUPAC Name: 5-acetamido-2-nitrobenzenesulfonic acid Traditional Name: 5-acetamido-2-nitro-besylic acid Formula: C8H8N2O6S MolecularWeight: 260.22392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C8H8N2O6S/c1-5(11)9-6-2-3-7(10(12)13)8(4-6)17(14,15)16/h2-4H,1H3,(H,9,11)(H,14,15,16)