2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol CAS Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-phenethyl-2-piperazinyl]ethanol IUPAC Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-phenethylpiperazin-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(3-ethyl-1H-imidazol-3-ium-2-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol Formula: C20H31N4O+ MolecularWeight: 343.48634

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC=C1)CN2CCN(C(C2)CCO)CCC3=CC=CC=C3

Isomeric SMILES

CC[N+]1=C(NC=C1)CN2CCN([C@H](C2)CCO)CCC3=CC=CC=C3

InChI

InChI=1S/C20H30N4O/c1-2-23-12-10-21-20(23)17-22-13-14-24(19(16-22)9-15-25)11-8-18-6-4-3-5-7-18/h3-7,10,12,19,25H,2,8-9,11,13-17H2,1H3/p+1/t19-/m0/s1