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

Systemtic Name: 2-[(2S)-4-[(2-methylphenyl)methyl]-1-[(4-methylphenyl)methyl]piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-(o-tolylmethyl)-1-(p-tolylmethyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2-methylphenyl)methyl]-1-[(4-methylphenyl)methyl]-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(2-methylphenyl)methyl]-1-[(4-methylphenyl)methyl]piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(2-methylbenzyl)-1-(4-methylbenzyl)piperazin-4-ium-2-yl]ethanol Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC[NH+](CC2CCO)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC[NH+](C[C@@H]2CCO)CC3=CC=CC=C3C

InChI

InChI=1S/C22H30N2O/c1-18-7-9-20(10-8-18)15-24-13-12-23(17-22(24)11-14-25)16-21-6-4-3-5-19(21)2/h3-10,22,25H,11-17H2,1-2H3/p+1/t22-/m0/s1