2-[[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[4-(5-chloro-2-methyl-phenyl)piperazino]methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C21H24ClN4O+ MolecularWeight: 383.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C

InChI

InChI=1S/C21H23ClN4O/c1-15-3-6-20-23-18(12-21(27)26(20)13-15)14-24-7-9-25(10-8-24)19-11-17(22)5-4-16(19)2/h3-6,11-13H,7-10,14H2,1-2H3/p+1