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

Systemtic Name: 7-bromanyl-2-[(4-ethanoylphenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-acetylphenoxy)methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(4-acetylphenoxy)methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(4-acetylphenoxy)methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-acetylphenoxy)methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H14BrN2O3+ MolecularWeight: 374.20866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C17H13BrN2O3/c1-11(21)12-2-5-15(6-3-12)23-10-14-8-17(22)20-9-13(18)4-7-16(20)19-14/h2-9H,10H2,1H3/p+1