2-[(2S)-4-[(4-methylphenyl)methyl]-1-(3-phenylpropyl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(4-methylphenyl)methyl]-1-(3-phenylpropyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-(3-phenylpropyl)-4-(p-tolylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(4-methylphenyl)methyl]-1-(3-phenylpropyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(4-methylphenyl)methyl]-1-(3-phenylpropyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(4-methylbenzyl)-1-(3-phenylpropyl)piperazin-1-ium-2-yl]ethanol Formula: C23H33N2O+ MolecularWeight: 353.52092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC[NH+](C(C2)CCO)CCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC[NH+]([C@H](C2)CCO)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H32N2O/c1-20-9-11-22(12-10-20)18-24-15-16-25(23(19-24)13-17-26)14-5-8-21-6-3-2-4-7-21/h2-4,6-7,9-12,23,26H,5,8,13-19H2,1H3/p+1/t23-/m0/s1