1-[(3-methylphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[(3-methylphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-(m-tolylmethyl)piperazine-1,4-diium CAS Name: 1-[(3-methylphenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-[(3-methylphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-(3-methylbenzyl)piperazine-1,4-diium Formula: C12H20N2+2 MolecularWeight: 192.3006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CC[NH2+]CC2

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CC[NH2+]CC2

InChI

InChI=1S/C12H18N2/c1-11-3-2-4-12(9-11)10-14-7-5-13-6-8-14/h2-4,9,13H,5-8,10H2,1H3/p+2