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

Systemtic Name: 2-[(4-quinoxalin-2-ylcarbonylpiperazin-1-yl)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[[4-(quinoxaline-2-carbonyl)piperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[4-[oxo(2-quinoxalinyl)methyl]-1-piperazinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[[4-(quinoxaline-2-carbonyl)piperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[4-(quinoxaline-2-carbonyl)piperazino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H21N6O2+ MolecularWeight: 401.44114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)[N+]3=CC=CC=C3N2)C(=O)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)[N+]3=CC=CC=C3N2)C(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C22H20N6O2/c29-21-13-16(24-20-7-3-4-8-28(20)21)15-26-9-11-27(12-10-26)22(30)19-14-23-17-5-1-2-6-18(17)25-19/h1-8,13-14H,9-12,15H2/p+1