(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-propan-2-ol Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxypropan-2-ol Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]propan-2-ol Formula: C19H39N2O2+ MolecularWeight: 327.52516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC2CC(CCC2C(C)C)C)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](CO[C@H]2C[C@H](CC[C@@H]2C(C)C)C)O

InChI

InChI=1S/C19H38N2O2/c1-5-20-8-10-21(11-9-20)13-17(22)14-23-19-12-16(4)6-7-18(19)15(2)3/h15-19,22H,5-14H2,1-4H3/p+1/t16-,17-,18+,19-/m0/s1