N-(3-ethylpent-1-yn-3-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C16H18N3O2+ MolecularWeight: 284.33302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1=CNC2=CC=CC=[N+]2C1=O

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1=CNC2=CC=CC=[N+]2C1=O

InChI

InChI=1S/C16H17N3O2/c1-4-16(5-2,6-3)18-14(20)12-11-17-13-9-7-8-10-19(13)15(12)21/h1,7-11H,5-6H2,2-3H3,(H,18,20)/p+1