1,4-bis[(3-methylphenyl)methyl]piperazin-1-ium

Systemtic Name: 1,4-bis[(3-methylphenyl)methyl]piperazin-1-ium Openeye Name: 1,4-bis(m-tolylmethyl)piperazin-1-ium CAS Name: 1,4-bis[(3-methylphenyl)methyl]piperazin-1-ium IUPAC Name: 1,4-bis[(3-methylphenyl)methyl]piperazin-1-ium Traditional Name: 1,4-bis(3-methylbenzyl)piperazin-1-ium Formula: C20H27N2+ MolecularWeight: 295.44178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)CC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)CC3=CC=CC(=C3)C

InChI

InChI=1S/C20H26N2/c1-17-5-3-7-19(13-17)15-21-9-11-22(12-10-21)16-20-8-4-6-18(2)14-20/h3-8,13-14H,9-12,15-16H2,1-2H3/p+1