(4R)-8-methyl-4-phenyl-2-piperidin-1-yl-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one

Systemtic Name: (4R)-8-methyl-4-phenyl-2-piperidin-1-yl-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Openeye Name: (4R)-8-methyl-4-phenyl-2-(1-piperidyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one CAS Name: (4R)-8-methyl-4-phenyl-2-(1-piperidinyl)-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one IUPAC Name: (4R)-8-methyl-4-phenyl-2-piperidin-1-yl-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Traditional Name: (4R)-8-methyl-4-phenyl-2-piperidino-4,9-dihydro-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-6-one Formula: C18H22N5O+ MolecularWeight: 324.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)[N+]2=C(N1)NC(=NC2C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC1=CC(=O)[N+]2=C(N1)NC(=N[C@H]2C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C18H21N5O/c1-13-12-15(24)23-16(14-8-4-2-5-9-14)20-17(21-18(23)19-13)22-10-6-3-7-11-22/h2,4-5,8-9,12,16H,3,6-7,10-11H2,1H3,(H,19,20,21,24)/p+1/t16-/m1/s1