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2-[(2S)-4-(cyclohexylmethyl)-1-(2,2-dimethylpropyl)piperazin-4-ium-2-yl]ethanol

2-[(2S)-4-(cyclohexylmethyl)-1-(2,2-dimethylpropyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name:2-[(2S)-4-(cyclohexylmethyl)-1-(2,2-dimethylpropyl)piperazin-4-ium-2-yl]ethanol
Openeye Name:2-[(2S)-4-(cyclohexylmethyl)-1-(2,2-dimethylpropyl)piperazin-4-ium-2-yl]ethanol
CAS Name:2-[(2S)-4-(cyclohexylmethyl)-1-(2,2-dimethylpropyl)-2-piperazin-4-iumyl]ethanol
IUPAC Name:2-[(2S)-4-(cyclohexylmethyl)-1-(2,2-dimethylpropyl)piperazin-4-ium-2-yl]ethanol
Traditional Name:2-[(2S)-4-(cyclohexylmethyl)-1-neopentyl-piperazin-4-ium-2-yl]ethanol
Formula: C18H37N2O+
MolecularWeight: 297.49918
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CC[NH+](CC1CCO)CC2CCCCC2


Isomeric SMILES

CC(C)(C)CN1CC[NH+](C[C@@H]1CCO)CC2CCCCC2


InChI

InChI=1S/C18H36N2O/c1-18(2,3)15-20-11-10-19(14-17(20)9-12-21)13-16-7-5-4-6-8-16/h16-17,21H,4-15H2,1-3H3/p+1/t17-/m0/s1


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