2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C15H29N4O+ MolecularWeight: 281.41696

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CN2CC[NH+](C(C2)CCO)C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CN2CC[NH+]([C@H](C2)CCO)C)C

InChI

InChI=1S/C15H28N4O/c1-5-19-13(3)15(12(2)16-19)11-18-8-7-17(4)14(10-18)6-9-20/h14,20H,5-11H2,1-4H3/p+1/t14-/m0/s1