2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-N-(3-piperidinosulfonylphenyl)acetamide Formula: C20H27N4O3S+ MolecularWeight: 403.51838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H26N4O3S/c1-22(2)18-9-13-23(14-10-18)16-20(25)21-17-7-6-8-19(15-17)28(26,27)24-11-4-3-5-12-24/h6-10,13-15H,3-5,11-12,16H2,1-2H3/p+1