2-azanyl-4-(2-hydroxyethyl)-5-nitro-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-(2-hydroxyethyl)-5-nitro-benzenesulfonic acid Openeye Name: 2-amino-4-(2-hydroxyethyl)-5-nitro-benzenesulfonic acid CAS Name: 2-amino-4-(2-hydroxyethyl)-5-nitrobenzenesulfonic acid IUPAC Name: 2-amino-4-(2-hydroxyethyl)-5-nitrobenzenesulfonic acid Traditional Name: 2-amino-4-(2-hydroxyethyl)-5-nitro-besylic acid Formula: C8H10N2O6S MolecularWeight: 262.2398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N)S(=O)(=O)O)[N+](=O)[O-])CCO

Isomeric SMILES

C1=C(C(=CC(=C1N)S(=O)(=O)O)[N+](=O)[O-])CCO

InChI

InChI=1S/C8H10N2O6S/c9-6-3-5(1-2-11)7(10(12)13)4-8(6)17(14,15)16/h3-4,11H,1-2,9H2,(H,14,15,16)