2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C15H21N3O+2 MolecularWeight: 259.34674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=CC(=O)[N+]3=CC=CC=C3N2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=CC(=O)[N+]3=CC=CC=C3N2

InChI

InChI=1S/C15H19N3O/c1-12-6-2-4-8-17(12)11-13-10-15(19)18-9-5-3-7-14(18)16-13/h3,5,7,9-10,12H,2,4,6,8,11H2,1H3/p+2/t12-/m0/s1