7-methyl-2-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-methyl-2-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-methyl-2-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-methyl-2-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-methyl-2-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)C[NH+]3CCN(CC3)C4=CC=CC=C4C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)C[NH+]3CCN(CC3)C4=CC=CC=C4C)C=C1

InChI

InChI=1S/C21H24N4O/c1-16-7-8-20-22-18(13-21(26)25(20)14-16)15-23-9-11-24(12-10-23)19-6-4-3-5-17(19)2/h3-8,13-14H,9-12,15H2,1-2H3/p+1