[3-(diethylcarbamoyl)pyridin-1-ium-1-yl]-(4-methylphenyl)sulfonyl-azanide

Systemtic Name: [3-(diethylcarbamoyl)pyridin-1-ium-1-yl]-(4-methylphenyl)sulfonyl-azanide Openeye Name: [3-(diethylcarbamoyl)pyridin-1-ium-1-yl]-(p-tolylsulfonyl)azanide CAS Name: [3-[diethylamino(oxo)methyl]-1-pyridin-1-iumyl]-(4-methylphenyl)sulfonylazanide IUPAC Name: [3-(diethylcarbamoyl)pyridin-1-ium-1-yl]-(4-methylphenyl)sulfonylazanide Traditional Name: [3-(diethylcarbamoyl)pyridin-1-ium-1-yl]-tosyl-azanide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C[N+](=CC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)C(=O)C1=C[N+](=CC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H21N3O3S/c1-4-19(5-2)17(21)15-7-6-12-20(13-15)18-24(22,23)16-10-8-14(3)9-11-16/h6-13H,4-5H2,1-3H3