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2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine

2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine

Systemtic Name:2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine
Openeye Name:2-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]pyrimidine
CAS Name:2-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]pyrimidine
IUPAC Name:2-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]pyrimidine
Traditional Name:2-[4-(3-methylbenzyl)piperazin-4-ium-1-yl]pyrimidine
Formula: C16H21N4+
MolecularWeight: 269.36474
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C3=NC=CC=N3


Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C3=NC=CC=N3


InChI

InChI=1S/C16H20N4/c1-14-4-2-5-15(12-14)13-19-8-10-20(11-9-19)16-17-6-3-7-18-16/h2-7,12H,8-11,13H2,1H3/p+1


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