3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]-oxomethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 3-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C16H20N3O2+ MolecularWeight: 286.3489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CNC3=CC=CC=[N+]3C2=O)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)C2=CNC3=CC=CC=[N+]3C2=O)C

InChI

InChI=1S/C16H19N3O2/c1-11-7-12(2)10-18(9-11)15(20)13-8-17-14-5-3-4-6-19(14)16(13)21/h3-6,8,11-12H,7,9-10H2,1-2H3/p+1/t11-,12-/m0/s1