N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-[4-(dimethylamino)-1-pyridin-1-iumyl]acetamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Formula: C22H21ClN3O2+ MolecularWeight: 394.87404

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3O2/c1-25(2)18-10-12-26(13-11-18)15-21(27)24-20-9-8-17(23)14-19(20)22(28)16-6-4-3-5-7-16/h3-14H,15H2,1-2H3/p+1