3-azanyl-5-chloranyl-4-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide

Systemtic Name: 3-azanyl-5-chloranyl-4-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide Openeye Name: 3-amino-5-chloro-4-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide CAS Name: 3-amino-5-chloro-4-methyl-N-(4-pyridin-1-iumyl)benzenesulfonamide IUPAC Name: 3-amino-5-chloro-4-methyl-N-pyridin-1-ium-4-ylbenzenesulfonamide Traditional Name: 3-amino-5-chloro-4-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide Formula: C12H13ClN3O2S+ MolecularWeight: 298.76852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1N)S(=O)(=O)NC2=CC=[NH+]C=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1N)S(=O)(=O)NC2=CC=[NH+]C=C2)Cl

InChI

InChI=1S/C12H12ClN3O2S/c1-8-11(13)6-10(7-12(8)14)19(17,18)16-9-2-4-15-5-3-9/h2-7H,14H2,1H3,(H,15,16)/p+1