2-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-bromo-2-fluoro-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(4-bromo-2-fluorophenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(4-bromo-2-fluorophenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-bromo-2-fluoro-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C16H13BrFN2O2+ MolecularWeight: 364.189023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H12BrFN2O2/c1-10-2-5-15-19-12(7-16(21)20(15)8-10)9-22-14-4-3-11(17)6-13(14)18/h2-8H,9H2,1H3/p+1