2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(2-methyl-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(2,3-dimethyl-1-pyridin-1-iumyl)-N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-(2-methyl-5-morpholinosulfonyl-phenyl)acetamide Formula: C20H26N3O4S+ MolecularWeight: 404.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C)C

Isomeric SMILES

CC1=C([N+](=CC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C)C

InChI

InChI=1S/C20H25N3O4S/c1-15-5-4-8-22(17(15)3)14-20(24)21-19-13-18(7-6-16(19)2)28(25,26)23-9-11-27-12-10-23/h4-8,13H,9-12,14H2,1-3H3/p+1