N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(5-ethyl-2-methyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-(5-ethyl-2-methylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)acetamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CCC1=C[N+](=C(C=C1)C)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-3-16-7-6-15(2)23(13-16)14-20(25)22-19-12-17(8-9-18(19)21)28(26,27)24-10-4-5-11-24/h6-9,12-13H,3-5,10-11,14H2,1-2H3/p+1