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methyl 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanoate

methyl 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanoate

Systemtic Name:methyl 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanoate
Openeye Name:methyl 2-[4-(o-tolylmethyl)piperazine-1,4-diium-1-yl]acetate
CAS Name:2-[4-[(2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]acetic acid methyl ester
IUPAC Name:methyl 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]acetate
Traditional Name:2-[4-(2-methylbenzyl)piperazine-1,4-diium-1-yl]acetic acid methyl ester
Formula: C15H24N2O2+2
MolecularWeight: 264.36326
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)OC


Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)OC


InChI

InChI=1S/C15H22N2O2/c1-13-5-3-4-6-14(13)11-16-7-9-17(10-8-16)12-15(18)19-2/h3-6H,7-12H2,1-2H3/p+2


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