(1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-pyridin-2-yl-ethanol

Systemtic Name: (1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-pyridin-2-yl-ethanol Openeye Name: (1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-(2-pyridyl)ethanol CAS Name: (1S)-2-(4-ethyl-1-piperazin-4-iumyl)-1-(2-pyridinyl)ethanol IUPAC Name: (1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-pyridin-2-ylethanol Traditional Name: (1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-(2-pyridyl)ethanol Formula: C13H22N3O+ MolecularWeight: 236.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(C2=CC=CC=N2)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](C2=CC=CC=N2)O

InChI

InChI=1S/C13H21N3O/c1-2-15-7-9-16(10-8-15)11-13(17)12-5-3-4-6-14-12/h3-6,13,17H,2,7-11H2,1H3/p+1/t13-/m0/s1