2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(5-ethyl-2-methyl-1-pyridin-1-iumyl)-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(5-ethyl-2-methylpyridin-1-ium-1-yl)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-piperidinosulfonylphenyl)acetamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O3S/c1-3-18-8-7-17(2)23(15-18)16-21(25)22-19-9-11-20(12-10-19)28(26,27)24-13-5-4-6-14-24/h7-12,15H,3-6,13-14,16H2,1-2H3/p+1