2-[(2S)-1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)methyl]piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)methyl]piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)methyl]piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)methyl]-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)methyl]piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-[(5-methyl-1H-pyrazol-3-yl)methyl]piperazin-4-ium-2-yl]ethanol Formula: C17H31N4O+ MolecularWeight: 307.45424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+]2CCN(C(C2)CCO)C3CCCCC3

Isomeric SMILES

CC1=CC(=NN1)C[NH+]2CCN([C@H](C2)CCO)C3CCCCC3

InChI

InChI=1S/C17H30N4O/c1-14-11-15(19-18-14)12-20-8-9-21(17(13-20)7-10-22)16-5-3-2-4-6-16/h11,16-17,22H,2-10,12-13H2,1H3,(H,18,19)/p+1/t17-/m0/s1