hydrogen sulfite; methylbenzene; dicyanate

Systemtic Name: hydrogen sulfite; methylbenzene; dicyanate Openeye Name: hydrogen sulfite; toluene; dicyanate CAS Name: hydrogen sulfite; toluene; dicyanate IUPAC Name: hydrogen sulfite; toluene; dicyanate Traditional Name: toluene bisulfite dicyanate Formula: C9H9N2O5S-3 MolecularWeight: 257.24316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C(#N)[O-].C(#N)[O-].OS(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1.C(#N)[O-].C(#N)[O-].OS(=O)[O-]

InChI

InChI=1S/C7H8.2CHNO.H2O3S/c1-7-5-3-2-4-6-7;2*2-1-3;1-4(2)3/h2-6H,1H3;2*3H;(H2,1,2,3)/p-3