N-(4-methylphenyl)sulfonyl-2-pyridin-1-ium-1-yl-ethanamide

Systemtic Name: N-(4-methylphenyl)sulfonyl-2-pyridin-1-ium-1-yl-ethanamide Openeye Name: N-(p-tolylsulfonyl)-2-pyridin-1-ium-1-yl-acetamide CAS Name: N-(4-methylphenyl)sulfonyl-2-(1-pyridin-1-iumyl)acetamide IUPAC Name: N-(4-methylphenyl)sulfonyl-2-pyridin-1-ium-1-ylacetamide Traditional Name: 2-pyridin-1-ium-1-yl-N-tosyl-acetamide Formula: C14H15N2O3S+ MolecularWeight: 291.3455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O3S/c1-12-5-7-13(8-6-12)20(18,19)15-14(17)11-16-9-3-2-4-10-16/h2-10H,11H2,1H3/p+1