2-(ethylsulfonylamino)-5-nitro-benzoic acid

Systemtic Name: 2-(ethylsulfonylamino)-5-nitro-benzoic acid Openeye Name: 2-(ethylsulfonylamino)-5-nitro-benzoic acid CAS Name: 2-(ethylsulfonylamino)-5-nitrobenzoic acid IUPAC Name: 2-(ethylsulfonylamino)-5-nitrobenzoic acid Traditional Name: 2-(esylamino)-5-nitro-benzoic acid Formula: C9H10N2O6S MolecularWeight: 274.2505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O6S/c1-2-18(16,17)10-8-4-3-6(11(14)15)5-7(8)9(12)13/h3-5,10H,2H2,1H3,(H,12,13)