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

Systemtic Name: (2S)-1-cyclohexyloxy-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(cyclohexoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-cyclohexyloxy-3-(4-ethyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-cyclohexyloxy-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(cyclohexoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C15H31N2O2+ MolecularWeight: 271.41884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC2CCCCC2)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COC2CCCCC2)O

InChI

InChI=1S/C15H30N2O2/c1-2-16-8-10-17(11-9-16)12-14(18)13-19-15-6-4-3-5-7-15/h14-15,18H,2-13H2,1H3/p+1/t14-/m0/s1