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

Systemtic Name: 2-[(2S)-4-cyclohexyl-1-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-cyclohexyl-1-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-cyclohexyl-1-[(4-ethoxyphenyl)methyl]-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-cyclohexyl-1-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-cyclohexyl-1-(4-ethoxybenzyl)piperazin-4-ium-2-yl]ethanol Formula: C21H35N2O2+ MolecularWeight: 347.5148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CC[NH+](CC2CCO)C3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CC[NH+](C[C@@H]2CCO)C3CCCCC3

InChI

InChI=1S/C21H34N2O2/c1-2-25-21-10-8-18(9-11-21)16-22-13-14-23(17-20(22)12-15-24)19-6-4-3-5-7-19/h8-11,19-20,24H,2-7,12-17H2,1H3/p+1/t20-/m0/s1