(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-prop-2-enoxy-propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-prop-2-enoxy-propan-2-ol Openeye Name: (2S)-1-allyloxy-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-prop-2-enoxy-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-prop-2-enoxypropan-2-ol Traditional Name: (2S)-1-allyloxy-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C12H25N2O2+ MolecularWeight: 229.3391

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COCC=C)O

Isomeric SMILES

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

InChI

InChI=1S/C12H24N2O2/c1-3-9-16-11-12(15)10-14-7-5-13(4-2)6-8-14/h3,12,15H,1,4-11H2,2H3/p+1/t12-/m0/s1