1-[3-(dimethylamino)propyl]-4-methyl-6-oxidanyl-5-pyridin-1-ium-1-yl-pyridin-2-one chloride

Systemtic Name: 1-[3-(dimethylamino)propyl]-4-methyl-6-oxidanyl-5-pyridin-1-ium-1-yl-pyridin-2-one chloride Openeye Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-pyridin-1-ium-1-yl-pyridin-2-one chloride CAS Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-(1-pyridin-1-iumyl)-2-pyridinone chloride IUPAC Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-pyridin-1-ium-1-ylpyridin-2-one chloride Traditional Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-pyridin-1-ium-1-yl-2-pyridone chloride Formula: C16H22ClN3O2 MolecularWeight: 323.81778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1[N+]2=CC=CC=C2)O)CCCN(C)C.[Cl-]

Isomeric SMILES

CC1=CC(=O)N(C(=C1[N+]2=CC=CC=C2)O)CCCN(C)C.[Cl-]

InChI

InChI=1S/C16H21N3O2.ClH/c1-13-12-14(20)19(11-7-8-17(2)3)16(21)15(13)18-9-5-4-6-10-18;/h4-6,9-10,12H,7-8,11H2,1-3H3;1H