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

Systemtic Name: 2-[(9-methyl-4-oxidanylidene-2-piperidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]propanedinitrile Openeye Name: 2-[[9-methyl-4-oxo-2-(1-piperidyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylene]propanedinitrile CAS Name: 2-[[9-methyl-4-oxo-2-(1-piperidinyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl]methylidene]propanedinitrile IUPAC Name: 2-[(9-methyl-4-oxo-2-piperidin-1-yl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]propanedinitrile Traditional Name: 2-[(4-keto-9-methyl-2-piperidino-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene]malononitrile Formula: C18H18N5O+ MolecularWeight: 320.36842

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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)N3CCCCC3

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C(C#N)C#N)N3CCCCC3

InChI

InChI=1S/C18H17N5O/c1-13-6-5-9-23-16(13)21-17(22-7-3-2-4-8-22)15(18(23)24)10-14(11-19)12-20/h5-6,9-10H,2-4,7-8H2,1H3/p+1