2-(2-phenyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-(2-phenyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-(2-phenyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-6-propyl-1H-pyrimidin-4-one CAS Name: 2-(2-phenyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-(2-phenyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-(2-phenyl-2-imidazolin-1-ium-1-yl)-6-propyl-1H-pyrimidin-4-one Formula: C16H19N4O+ MolecularWeight: 283.34826

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)[N+]2=C(NCC2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)[N+]2=C(NCC2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N4O/c1-2-6-13-11-14(21)19-16(18-13)20-10-9-17-15(20)12-7-4-3-5-8-12/h3-5,7-8,11H,2,6,9-10H2,1H3,(H,18,19,21)/p+1