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

Systemtic Name: 2-[(2S)-1-(2-methylpropyl)-4-propyl-piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-isobutyl-4-propyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(2-methylpropyl)-4-propyl-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-(2-methylpropyl)-4-propylpiperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-isobutyl-4-propyl-piperazin-4-ium-2-yl]ethanol Formula: C13H29N2O+ MolecularWeight: 229.38216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H28N2O/c1-4-6-14-7-8-15(10-12(2)3)13(11-14)5-9-16/h12-13,16H,4-11H2,1-3H3/p+1/t13-/m0/s1