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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CC[NH+](C(C1)CCO)CC2CCCCC2

Isomeric SMILES

CC(C)(C)CN1CC[NH+]([C@H](C1)CCO)CC2CCCCC2

InChI

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