(1S,2S)-2-[4-[3-(4-methoxyphenyl)propyl]piperazin-4-ium-1-yl]cyclohexan-1-ol

Systemtic Name: (1S,2S)-2-[4-[3-(4-methoxyphenyl)propyl]piperazin-4-ium-1-yl]cyclohexan-1-ol Openeye Name: (1S,2S)-2-[4-[3-(4-methoxyphenyl)propyl]piperazin-4-ium-1-yl]cyclohexanol CAS Name: (1S,2S)-2-[4-[3-(4-methoxyphenyl)propyl]-1-piperazin-4-iumyl]-1-cyclohexanol IUPAC Name: (1S,2S)-2-[4-[3-(4-methoxyphenyl)propyl]piperazin-4-ium-1-yl]cyclohexan-1-ol Traditional Name: (1S,2S)-2-[4-[3-(4-methoxyphenyl)propyl]piperazin-4-ium-1-yl]cyclohexanol Formula: C20H33N2O2+ MolecularWeight: 333.48822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC[NH+]2CCN(CC2)C3CCCCC3O

Isomeric SMILES

COC1=CC=C(C=C1)CCC[NH+]2CCN(CC2)[C@H]3CCCC[C@@H]3O

InChI

InChI=1S/C20H32N2O2/c1-24-18-10-8-17(9-11-18)5-4-12-21-13-15-22(16-14-21)19-6-2-3-7-20(19)23/h8-11,19-20,23H,2-7,12-16H2,1H3/p+1/t19-,20-/m0/s1