2-[(2S)-1-cyclohexyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[(1,5-dimethyl-4-pyrazolyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C18H33N4O+ MolecularWeight: 321.48082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN2CC[NH+](C(C2)CCO)C3CCCCC3

Isomeric SMILES

CC1=C(C=NN1C)CN2CC[NH+]([C@H](C2)CCO)C3CCCCC3

InChI

InChI=1S/C18H32N4O/c1-15-16(12-19-20(15)2)13-21-9-10-22(18(14-21)8-11-23)17-6-4-3-5-7-17/h12,17-18,23H,3-11,13-14H2,1-2H3/p+1/t18-/m0/s1