2-(4-ethylpyridin-1-ium-1-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4-ethylpyridin-1-ium-1-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4-ethylpyridin-1-ium-1-yl)-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(4-ethyl-1-pyridin-1-iumyl)-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-ethylpyridin-1-ium-1-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-ethylpyridin-1-ium-1-yl)-N-(2-methoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-3-17-9-13-23(14-10-17)16-21(25)22-19-15-18(7-8-20(19)28-2)29(26,27)24-11-5-4-6-12-24/h7-10,13-15H,3-6,11-12,16H2,1-2H3/p+1