(2-azanyl-3,5-dinitro-phenyl)methanesulfinate

Systemtic Name: (2-azanyl-3,5-dinitro-phenyl)methanesulfinate Openeye Name: (2-amino-3,5-dinitro-phenyl)methanesulfinate CAS Name: (2-amino-3,5-dinitrophenyl)methanesulfinate IUPAC Name: (2-amino-3,5-dinitrophenyl)methanesulfinate Traditional Name: (2-amino-3,5-dinitro-phenyl)methanesulfinate Formula: C7H6N3O6S- MolecularWeight: 260.20404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])N)CS(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])N)CS(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H7N3O6S/c8-7-4(3-17(15)16)1-5(9(11)12)2-6(7)10(13)14/h1-2H,3,8H2,(H,15,16)/p-1