6-[2-(4-chlorophenyl)ethylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[2-(4-chlorophenyl)ethylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[2-(4-chlorophenyl)ethylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[2-(4-chlorophenyl)ethylamino]-N,N-diethyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[2-(4-chlorophenyl)ethylamino]-N,N-diethylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[2-(4-chlorophenyl)ethylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide Formula: C17H23ClN3O2S+ MolecularWeight: 368.90142

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClN3O2S/c1-3-21(4-2)24(22,23)16-9-10-17(20-13-16)19-12-11-14-5-7-15(18)8-6-14/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,20)/p+1