2-[(2S)-4-[[3-(2-hydroxyethyloxy)phenyl]methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[[3-(2-hydroxyethyloxy)phenyl]methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[[3-(2-hydroxyethoxy)phenyl]methyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[[3-(2-hydroxyethoxy)phenyl]methyl]-1-phenethyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[[3-(2-hydroxyethoxy)phenyl]methyl]-1-phenethylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[3-(2-hydroxyethoxy)benzyl]-1-phenethyl-piperazin-1-ium-2-yl]ethanol Formula: C23H33N2O3+ MolecularWeight: 385.51972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH+]1CCC2=CC=CC=C2)CCO)CC3=CC(=CC=C3)OCCO

Isomeric SMILES

C1CN(C[C@@H]([NH+]1CCC2=CC=CC=C2)CCO)CC3=CC(=CC=C3)OCCO

InChI

InChI=1S/C23H32N2O3/c26-14-10-22-19-24(18-21-7-4-8-23(17-21)28-16-15-27)12-13-25(22)11-9-20-5-2-1-3-6-20/h1-8,17,22,26-27H,9-16,18-19H2/p+1/t22-/m0/s1