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

Systemtic Name: 4-oxidanylidene-N-(pyridin-3-ylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: 4-oxo-N-(3-pyridylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: 4-oxo-N-(3-pyridinylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: 4-oxo-N-(pyridin-3-ylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: 4-keto-N-(3-pyridylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C15H13N4O2+ MolecularWeight: 281.28932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NC=C(C2=O)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1=CC=[N+]2C(=C1)NC=C(C2=O)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C15H12N4O2/c20-14(18-9-11-4-3-6-16-8-11)12-10-17-13-5-1-2-7-19(13)15(12)21/h1-8,10H,9H2,(H,18,20)/p+1