N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(2,3-dimethyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-(2,3-dimethylpyridin-1-ium-1-yl)acetamide Formula: C19H23ClN3O3S+ MolecularWeight: 408.92222

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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)N3CCCC3)Cl)C

Isomeric SMILES

CC1=C([N+](=CC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)C

InChI

InChI=1S/C19H22ClN3O3S/c1-14-6-5-9-22(15(14)2)13-19(24)21-18-12-16(7-8-17(18)20)27(25,26)23-10-3-4-11-23/h5-9,12H,3-4,10-11,13H2,1-2H3/p+1