6-[(3-chlorophenyl)methylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[(3-chlorophenyl)methylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[(3-chlorophenyl)methylamino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[(3-chlorophenyl)methylamino]-N,N-diethyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[(3-chlorophenyl)methylamino]-N,N-diethylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[(3-chlorobenzyl)amino]-N,N-diethyl-pyridin-1-ium-3-sulfonamide Formula: C16H21ClN3O2S+ MolecularWeight: 354.87484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClN3O2S/c1-3-20(4-2)23(21,22)15-8-9-16(19-12-15)18-11-13-6-5-7-14(17)10-13/h5-10,12H,3-4,11H2,1-2H3,(H,18,19)/p+1