(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(2-methylpent-4-yn-2-yloxy)propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(2-methylpent-4-yn-2-yloxy)propan-2-ol Openeye Name: (2S)-1-(1,1-dimethylbut-3-ynoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-(2-methylpent-4-yn-2-yloxy)-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(2-methylpent-4-yn-2-yloxy)propan-2-ol Traditional Name: (2S)-1-(1,1-dimethylbut-3-ynoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C15H29N2O2+ MolecularWeight: 269.40296

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC(C)(C)CC#C)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COC(C)(C)CC#C)O

InChI

InChI=1S/C15H28N2O2/c1-5-7-15(3,4)19-13-14(18)12-17-10-8-16(6-2)9-11-17/h1,14,18H,6-13H2,2-4H3/p+1/t14-/m0/s1