2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-3-ium-4-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-3-ium-4-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-3-ium-4-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-3-ium-4-yl)methyl]-1-phenethyl-2-piperazinyl]ethanol IUPAC Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-3-ium-4-yl)methyl]-1-phenethylpiperazin-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-3-ium-4-yl)methyl]-1-phenethyl-piperazin-2-yl]ethanol Formula: C21H33N4O+ MolecularWeight: 357.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[NH+]C(=C(N1)C)CN2CCN(C(C2)CCO)CCC3=CC=CC=C3

Isomeric SMILES

CCC1=[NH+]C(=C(N1)C)CN2CCN([C@H](C2)CCO)CCC3=CC=CC=C3

InChI

InChI=1S/C21H32N4O/c1-3-21-22-17(2)20(23-21)16-24-12-13-25(19(15-24)10-14-26)11-9-18-7-5-4-6-8-18/h4-8,19,26H,3,9-16H2,1-2H3,(H,22,23)/p+1/t19-/m0/s1