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

Systemtic Name: 1-[3-(dimethylamino)propyl]-4-methyl-6-oxidanyl-5-pyridin-1-ium-1-yl-pyridin-2-one Openeye Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-pyridin-1-ium-1-yl-pyridin-2-one CAS Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-(1-pyridin-1-iumyl)-2-pyridinone IUPAC Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-pyridin-1-ium-1-ylpyridin-2-one Traditional Name: 1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-5-pyridin-1-ium-1-yl-2-pyridone Formula: C16H22N3O2+ MolecularWeight: 288.36478

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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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O2/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/p+1