8-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-5H-pyrido[2,1-b]quinazolin-10-ium-11-one

Systemtic Name: 8-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Openeye Name: 8-[4-(2-pyridyl)piperazine-1-carbonyl]-5H-pyrido[2,1-b]quinazolin-10-ium-11-one CAS Name: 8-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-5H-pyrido[2,1-b]quinazolin-10-ium-11-one IUPAC Name: 8-(4-pyridin-2-ylpiperazine-1-carbonyl)-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Traditional Name: 8-[4-(2-pyridyl)piperazine-1-carbonyl]-5H-pyrido[2,1-b]quinazolin-10-ium-11-one Formula: C22H20N5O2+ MolecularWeight: 386.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C[N+]4=C(C=C3)NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C[N+]4=C(C=C3)NC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H19N5O2/c28-21(26-13-11-25(12-14-26)19-7-3-4-10-23-19)16-8-9-20-24-18-6-2-1-5-17(18)22(29)27(20)15-16/h1-10,15H,11-14H2/p+1