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

Systemtic Name: (1S,2S)-2-[4-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]piperazin-1-yl]cyclohexan-1-ol Openeye Name: (1S,2S)-2-[4-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]piperazin-1-yl]cyclohexanol CAS Name: (1S,2S)-2-[4-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]-1-piperazinyl]-1-cyclohexanol IUPAC Name: (1S,2S)-2-[4-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]piperazin-1-yl]cyclohexan-1-ol Traditional Name: (1S,2S)-2-[4-[(2-phenyl-1H-imidazol-3-ium-5-yl)methyl]piperazino]cyclohexanol Formula: C20H29N4O+ MolecularWeight: 341.47046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N2CCN(CC2)CC3=C[NH+]=C(N3)C4=CC=CC=C4)O

Isomeric SMILES

C1CC[C@@H]([C@H](C1)N2CCN(CC2)CC3=C[NH+]=C(N3)C4=CC=CC=C4)O

InChI

InChI=1S/C20H28N4O/c25-19-9-5-4-8-18(19)24-12-10-23(11-13-24)15-17-14-21-20(22-17)16-6-2-1-3-7-16/h1-3,6-7,14,18-19,25H,4-5,8-13,15H2,(H,21,22)/p+1/t18-,19-/m0/s1