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

Systemtic Name: 7-bromanyl-2-[[4-ethanoyl-2-(methoxymethyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[[4-acetyl-2-(methoxymethyl)phenoxy]methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[4-acetyl-2-(methoxymethyl)phenoxy]methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[[4-acetyl-2-(methoxymethyl)phenoxy]methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[4-acetyl-2-(methoxymethyl)phenoxy]methyl]-7-bromo-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H18BrN2O4+ MolecularWeight: 418.26122

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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)COC

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O4/c1-12(23)13-3-5-17(14(7-13)10-25-2)26-11-16-8-19(24)22-9-15(20)4-6-18(22)21-16/h3-9H,10-11H2,1-2H3/p+1