N-[(4-methylphenyl)methyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: 4-oxo-N-(p-tolylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: 4-keto-N-(4-methylbenzyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C17H16N3O2+ MolecularWeight: 294.32784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CNC3=CC=CC=[N+]3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CNC3=CC=CC=[N+]3C2=O

InChI

InChI=1S/C17H15N3O2/c1-12-5-7-13(8-6-12)10-19-16(21)14-11-18-15-4-2-3-9-20(15)17(14)22/h2-9,11H,10H2,1H3,(H,19,21)/p+1