ethyl (4R)-4-(2-fluorophenyl)-2-methyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate

Systemtic Name: ethyl (4R)-4-(2-fluorophenyl)-2-methyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate Openeye Name: ethyl (4R)-4-(2-fluorophenyl)-2-methyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate CAS Name: (4R)-4-(2-fluorophenyl)-2-methyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-(2-fluorophenyl)-2-methyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate Traditional Name: (4R)-4-(2-fluorophenyl)-2-methyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylic acid ethyl ester Formula: C20H19FN3O2+ MolecularWeight: 352.382163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=[N+](C1C3=CC=CC=C3F)C4=CC=CC=C4N2)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=[N+]([C@H]1C3=CC=CC=C3F)C4=CC=CC=C4N2)C

InChI

InChI=1S/C20H18FN3O2/c1-3-26-19(25)17-12(2)22-20-23-15-10-6-7-11-16(15)24(20)18(17)13-8-4-5-9-14(13)21/h4-11,18H,3H2,1-2H3,(H,22,23,25)/p+1/t18-/m0/s1