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

Systemtic Name: 2-[(2S)-1-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C18H28N4O+2 MolecularWeight: 316.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=C(N1)C2=CC=CC=C2)CN3CC[NH+](C(C3)CCO)C

Isomeric SMILES

CC1=C([NH+]=C(N1)C2=CC=CC=C2)CN3CC[NH+]([C@H](C3)CCO)C

InChI

InChI=1S/C18H26N4O/c1-14-17(20-18(19-14)15-6-4-3-5-7-15)13-22-10-9-21(2)16(12-22)8-11-23/h3-7,16,23H,8-13H2,1-2H3,(H,19,20)/p+2/t16-/m0/s1