4-methyl-N-pyridin-1-ium-1-yl-benzenesulfonimidic acid

Systemtic Name: 4-methyl-N-pyridin-1-ium-1-yl-benzenesulfonimidic acid Openeye Name: 4-methyl-N-pyridin-1-ium-1-yl-benzenesulfonimidic acid CAS Name: 4-methyl-N-(1-pyridin-1-iumyl)benzenesulfonimidic acid IUPAC Name: 4-methyl-N-pyridin-1-ium-1-ylbenzenesulfonimidic acid Traditional Name: 4-methyl-N-pyridin-1-ium-1-yl-benzenesulfonimidic acid Formula: C12H13N2O2S+ MolecularWeight: 249.30882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=N[N+]2=CC=CC=C2)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=N[N+]2=CC=CC=C2)(=O)O

InChI

InChI=1S/C12H12N2O2S/c1-11-5-7-12(8-6-11)17(15,16)13-14-9-3-2-4-10-14/h2-10H,1H3/p+1