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

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethylazanium Openeye Name: 2-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]ethylammonium CAS Name: 2-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]ethylammonium IUPAC Name: 2-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]ethylazanium Traditional Name: 2-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]ethylammonium Formula: C14H25N3+2 MolecularWeight: 235.3684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)CC[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)CC[NH3+]

InChI

InChI=1S/C14H23N3/c1-13-2-4-14(5-3-13)12-17-10-8-16(7-6-15)9-11-17/h2-5H,6-12,15H2,1H3/p+2