5-azanyl-2-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide

Systemtic Name: 5-azanyl-2-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide Openeye Name: 5-amino-2-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide CAS Name: 5-amino-2-methyl-N-(4-pyridin-1-iumyl)benzenesulfonamide IUPAC Name: 5-amino-2-methyl-N-pyridin-1-ium-4-ylbenzenesulfonamide Traditional Name: 5-amino-2-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide Formula: C12H14N3O2S+ MolecularWeight: 264.32346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N)S(=O)(=O)NC2=CC=[NH+]C=C2

Isomeric SMILES

CC1=C(C=C(C=C1)N)S(=O)(=O)NC2=CC=[NH+]C=C2

InChI

InChI=1S/C12H13N3O2S/c1-9-2-3-10(13)8-12(9)18(16,17)15-11-4-6-14-7-5-11/h2-8H,13H2,1H3,(H,14,15)/p+1