2-[[4-(phenylcarbonyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[4-(phenylcarbonyl)phenoxy]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-benzoylphenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(4-benzoylphenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(4-benzoylphenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-benzoylphenoxy)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H17N2O3+ MolecularWeight: 357.38198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC3=CC(=O)[N+]4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC3=CC(=O)[N+]4=CC=CC=C4N3

InChI

InChI=1S/C22H16N2O3/c25-21-14-18(23-20-8-4-5-13-24(20)21)15-27-19-11-9-17(10-12-19)22(26)16-6-2-1-3-7-16/h1-14H,15H2/p+1