(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-(2-thienyl)propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-2-thiophen-2-yl-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-thiophen-2-ylpropan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-(2-thienyl)propan-2-ol Formula: C13H23N2OS+ MolecularWeight: 255.39952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(C)(C2=CC=CS2)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@](C)(C2=CC=CS2)O

InChI

InChI=1S/C13H22N2OS/c1-3-14-6-8-15(9-7-14)11-13(2,16)12-5-4-10-17-12/h4-5,10,16H,3,6-9,11H2,1-2H3/p+1/t13-/m0/s1