2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propylamino]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propylamino]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propylamino]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propylamino]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propylamino]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[3-[4-(4-methoxyphenyl)piperazino]propylamino]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H28N5O2+ MolecularWeight: 394.49002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC3=CC(=O)[N+]4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC3=CC(=O)[N+]4=CC=CC=C4N3

InChI

InChI=1S/C22H27N5O2/c1-29-19-8-6-18(7-9-19)26-15-13-25(14-16-26)11-4-10-23-20-17-22(28)27-12-3-2-5-21(27)24-20/h2-3,5-9,12,17H,4,10-11,13-16H2,1H3,(H,23,28)/p+1