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

Systemtic Name: 2-[(2S)-1-[(4-methylphenyl)methyl]-4-propyl-piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-propyl-1-(p-tolylmethyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-[(4-methylphenyl)methyl]-4-propyl-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-[(4-methylphenyl)methyl]-4-propylpiperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(4-methylbenzyl)-4-propyl-piperazin-4-ium-2-yl]ethanol Formula: C17H29N2O+ MolecularWeight: 277.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(C(C1)CCO)CC2=CC=C(C=C2)C

Isomeric SMILES

CCC[NH+]1CCN([C@H](C1)CCO)CC2=CC=C(C=C2)C

InChI

InChI=1S/C17H28N2O/c1-3-9-18-10-11-19(17(14-18)8-12-20)13-16-6-4-15(2)5-7-16/h4-7,17,20H,3,8-14H2,1-2H3/p+1/t17-/m0/s1