4-methoxy-N-(pyridin-1-ium-3-ylmethyl)benzenesulfonamide

Systemtic Name: 4-methoxy-N-(pyridin-1-ium-3-ylmethyl)benzenesulfonamide Openeye Name: 4-methoxy-N-(pyridin-1-ium-3-ylmethyl)benzenesulfonamide CAS Name: 4-methoxy-N-(3-pyridin-1-iumylmethyl)benzenesulfonamide IUPAC Name: 4-methoxy-N-(pyridin-1-ium-3-ylmethyl)benzenesulfonamide Traditional Name: 4-methoxy-N-(pyridin-1-ium-3-ylmethyl)benzenesulfonamide Formula: C13H15N2O3S+ MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC2=C[NH+]=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCC2=C[NH+]=CC=C2

InChI

InChI=1S/C13H14N2O3S/c1-18-12-4-6-13(7-5-12)19(16,17)15-10-11-3-2-8-14-9-11/h2-9,15H,10H2,1H3/p+1