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

Systemtic Name: 1-[3-(2,2-dicyanoethenyl)-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl]piperidine-4-carboxamide Openeye Name: 1-[3-(2,2-dicyanovinyl)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl]piperidine-4-carboxamide CAS Name: 1-[3-(2,2-dicyanoethenyl)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-[3-(2,2-dicyanoethenyl)-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl]piperidine-4-carboxamide Traditional Name: 1-[3-(2,2-dicyanovinyl)-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl]isonipecotamide Formula: C19H19N6O2+ MolecularWeight: 363.39316

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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)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=C(C#N)C#N)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C19H18N6O2/c1-12-3-2-6-25-17(12)23-18(15(19(25)27)9-13(10-20)11-21)24-7-4-14(5-8-24)16(22)26/h2-3,6,9,14H,4-5,7-8H2,1H3,(H2,22,26)/p+1