N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-methylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-methylpyridin-1-ium-1-yl)ethanamide Openeye Name: N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-2-(2-methylpyridin-1-ium-1-yl)acetamide CAS Name: N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-2-(2-methyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-(2-methylpyridin-1-ium-1-yl)acetamide Traditional Name: N-(2-chloro-5-piperidinosulfonyl-phenyl)-2-(2-methylpyridin-1-ium-1-yl)acetamide Formula: C19H23ClN3O3S+ MolecularWeight: 408.92222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC1=CC=CC=[N+]1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C19H22ClN3O3S/c1-15-7-3-6-10-22(15)14-19(24)21-18-13-16(8-9-17(18)20)27(25,26)23-11-4-2-5-12-23/h3,6-10,13H,2,4-5,11-12,14H2,1H3/p+1