2-[[4-(4-ethanoylpiperazin-1-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[4-(4-ethanoylpiperazin-1-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[[4-(4-acetylpiperazin-1-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[4-(4-acetyl-1-piperazinyl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[[4-(4-acetylpiperazin-1-yl)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[4-(4-acetylpiperazino)phenoxy]methyl]-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)COC3=CC=C(C=C3)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)COC3=CC=C(C=C3)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C22H24N4O3/c1-16-4-3-9-26-21(28)14-18(23-22(16)26)15-29-20-7-5-19(6-8-20)25-12-10-24(11-13-25)17(2)27/h3-9,14H,10-13,15H2,1-2H3/p+1