5-(2H-azirin-3-ylamino)-2-nitro-benzenesulfonic acid

Systemtic Name: 5-(2H-azirin-3-ylamino)-2-nitro-benzenesulfonic acid Openeye Name: 5-(2H-azirin-3-ylamino)-2-nitro-benzenesulfonic acid CAS Name: 5-(2H-azirin-3-ylamino)-2-nitrobenzenesulfonic acid IUPAC Name: 5-(2H-azirin-3-ylamino)-2-nitrobenzenesulfonic acid Traditional Name: 5-(2H-azirin-3-ylamino)-2-nitro-besylic acid Formula: C8H7N3O5S MolecularWeight: 257.22328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=N1)NC2=CC(=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1C(=N1)NC2=CC(=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C8H7N3O5S/c12-11(13)6-2-1-5(10-8-4-9-8)3-7(6)17(14,15)16/h1-3H,4H2,(H,9,10)(H,14,15,16)