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

Systemtic Name: 6-[(4-chlorophenyl)methyl-methyl-amino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[(4-chlorophenyl)methyl-methyl-amino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[(4-chlorophenyl)methyl-methylamino]-N,N-diethyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[(4-chlorophenyl)methyl-methylamino]-N,N-diethylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[(4-chlorobenzyl)-methyl-amino]-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)N(C)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)N(C)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClN3O2S/c1-4-21(5-2)24(22,23)16-10-11-17(19-12-16)20(3)13-14-6-8-15(18)9-7-14/h6-12H,4-5,13H2,1-3H3/p+1