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

Systemtic Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1-[(2-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1-(o-tolylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1-[(2-methylphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1-[(2-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-1-(2-methylbenzyl)piperazin-1-ium-2-yl]ethanol Formula: C21H33N4O+ MolecularWeight: 357.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)CN2CC[NH+](C(C2)CCO)CC3=CC=CC=C3C

Isomeric SMILES

CCC1=NC(=C(N1)C)CN2CC[NH+]([C@H](C2)CCO)CC3=CC=CC=C3C

InChI

InChI=1S/C21H32N4O/c1-4-21-22-17(3)20(23-21)15-24-10-11-25(19(14-24)9-12-26)13-18-8-6-5-7-16(18)2/h5-8,19,26H,4,9-15H2,1-3H3,(H,22,23)/p+1/t19-/m0/s1