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

Systemtic Name: (1S,2S)-2-[4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-yl]cyclohexan-1-ol Openeye Name: (1S,2S)-2-[4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-yl]cyclohexanol CAS Name: (1S,2S)-2-[4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]-1-piperazinyl]-1-cyclohexanol IUPAC Name: (1S,2S)-2-[4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazin-1-yl]cyclohexan-1-ol Traditional Name: (1S,2S)-2-[4-[(5-methyl-2-phenyl-1H-imidazol-3-ium-4-yl)methyl]piperazino]cyclohexanol Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([NH+]=C(N1)C2=CC=CC=C2)CN3CCN(CC3)C4CCCCC4O

Isomeric SMILES

CC1=C([NH+]=C(N1)C2=CC=CC=C2)CN3CCN(CC3)[C@H]4CCCC[C@@H]4O

InChI

InChI=1S/C21H30N4O/c1-16-18(23-21(22-16)17-7-3-2-4-8-17)15-24-11-13-25(14-12-24)19-9-5-6-10-20(19)26/h2-4,7-8,19-20,26H,5-6,9-15H2,1H3,(H,22,23)/p+1/t19-,20-/m0/s1