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

Systemtic Name: 2-[[2-(3,5-dimethylphenoxy)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile Openeye Name: 2-[[2-(3,5-dimethylphenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]propanedinitrile CAS Name: 2-[[2-(3,5-dimethylphenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile IUPAC Name: 2-[[2-(3,5-dimethylphenoxy)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile Traditional Name: 2-[[2-(3,5-dimethylphenoxy)-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]malononitrile Formula: C21H17N4O2+ MolecularWeight: 357.38528

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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(=CC(=C3)C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H16N4O2/c1-13-7-14(2)9-17(8-13)27-20-18(10-16(11-22)12-23)21(26)25-6-4-5-15(3)19(25)24-20/h4-10H,1-3H3/p+1