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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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