2-[1-[(3-methylphenyl)methyl]piperazine-1,4-diium-2-yl]ethanol

Systemtic Name: 2-[1-[(3-methylphenyl)methyl]piperazine-1,4-diium-2-yl]ethanol Openeye Name: 2-[1-(m-tolylmethyl)piperazine-1,4-diium-2-yl]ethanol CAS Name: 2-[1-[(3-methylphenyl)methyl]-2-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[1-[(3-methylphenyl)methyl]piperazine-1,4-diium-2-yl]ethanol Traditional Name: 2-[1-(3-methylbenzyl)piperazine-1,4-diium-2-yl]ethanol Formula: C14H24N2O+2 MolecularWeight: 236.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CC[NH2+]CC2CCO

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CC[NH2+]CC2CCO

InChI

InChI=1S/C14H22N2O/c1-12-3-2-4-13(9-12)11-16-7-6-15-10-14(16)5-8-17/h2-4,9,14-15,17H,5-8,10-11H2,1H3/p+2