3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-[4-(o-tolylmethyl)piperazine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-[[4-[(2-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 3-[4-[(2-methylphenyl)methyl]piperazine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-[4-(2-methylbenzyl)piperazine-1-carbonyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CNC4=CC=CC=[N+]4C3=O

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CNC4=CC=CC=[N+]4C3=O

InChI

InChI=1S/C21H22N4O2/c1-16-6-2-3-7-17(16)15-23-10-12-24(13-11-23)20(26)18-14-22-19-8-4-5-9-25(19)21(18)27/h2-9,14H,10-13,15H2,1H3/p+1