2-[[2-(4-bromanylphenoxy)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[2-(4-bromanylphenoxy)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile Openeye Name: 2-[[2-(4-bromophenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]propanedinitrile CAS Name: 2-[[2-(4-bromophenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile IUPAC Name: 2-[[2-(4-bromophenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile Traditional Name: 2-[[2-(4-bromophenoxy)-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]malononitrile Formula: C19H12BrN4O2+ MolecularWeight: 408.22818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C(C#N)C#N)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C(C#N)C#N)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H11BrN4O2/c1-12-3-2-8-24-17(12)23-18(26-15-6-4-14(20)5-7-15)16(19(24)25)9-13(10-21)11-22/h2-9H,1H3/p+1