2-[(2S)-4-[[4-(2-hydroxyethyloxy)phenyl]methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[[4-(2-hydroxyethyloxy)phenyl]methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[[4-(2-hydroxyethoxy)phenyl]methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[[4-(2-hydroxyethoxy)phenyl]methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[[4-(2-hydroxyethoxy)phenyl]methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[4-(2-hydroxyethoxy)benzyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C16H27N2O3+ MolecularWeight: 295.39718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1CCO)CC2=CC=C(C=C2)OCCO

Isomeric SMILES

C[NH+]1CCN(C[C@@H]1CCO)CC2=CC=C(C=C2)OCCO

InChI

InChI=1S/C16H26N2O3/c1-17-7-8-18(13-15(17)6-9-19)12-14-2-4-16(5-3-14)21-11-10-20/h2-5,15,19-20H,6-13H2,1H3/p+1/t15-/m0/s1