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

Systemtic Name: 3-[(9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]benzenecarbonitrile Openeye Name: 3-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]benzonitrile CAS Name: 3-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]benzonitrile IUPAC Name: 3-[(9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]benzonitrile Traditional Name: 3-[(4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylamino]benzonitrile Formula: C17H15N4O+ MolecularWeight: 291.3272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CNC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CNC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H14N4O/c1-12-4-3-7-21-16(22)9-15(20-17(12)21)11-19-14-6-2-5-13(8-14)10-18/h2-9,19H,11H2,1H3/p+1