2-[(2S)-1-cyclohexyl-4-[[4-(2-hydroxyethyloxy)phenyl]methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[[4-(2-hydroxyethyloxy)phenyl]methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[[4-(2-hydroxyethoxy)phenyl]methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[[4-(2-hydroxyethoxy)phenyl]methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[[4-(2-hydroxyethoxy)phenyl]methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-[4-(2-hydroxyethoxy)benzyl]piperazin-1-ium-2-yl]ethanol Formula: C21H35N2O3+ MolecularWeight: 363.5142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2CCO)CC3=CC=C(C=C3)OCCO

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(C[C@@H]2CCO)CC3=CC=C(C=C3)OCCO

InChI

InChI=1S/C21H34N2O3/c24-13-10-20-17-22(11-12-23(20)19-4-2-1-3-5-19)16-18-6-8-21(9-7-18)26-15-14-25/h6-9,19-20,24-25H,1-5,10-17H2/p+1/t20-/m0/s1