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

Systemtic Name: 2-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]phenol Traditional Name: 2-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]phenol Formula: C18H23N2O+ MolecularWeight: 283.38802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=CC=CC=C3O

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=CC=CC=C3O

InChI

InChI=1S/C18H22N2O/c1-15-6-2-3-7-16(15)14-19-10-12-20(13-11-19)17-8-4-5-9-18(17)21/h2-9,21H,10-14H2,1H3/p+1