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

Systemtic Name: 2-[[4-(phenylcarbonyl)piperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-benzoylpiperazin-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(4-benzoyl-1-piperazinyl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(4-benzoylpiperazin-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-benzoylpiperazino)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C20H21N4O2+ MolecularWeight: 349.40634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)[N+]3=CC=CC=C3N2)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)[N+]3=CC=CC=C3N2)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O2/c25-19-14-17(21-18-8-4-5-9-24(18)19)15-22-10-12-23(13-11-22)20(26)16-6-2-1-3-7-16/h1-9,14H,10-13,15H2/p+1