2-[(2S)-4-cyclooctyl-1-(phenylmethyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-cyclooctyl-1-(phenylmethyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-benzyl-4-cyclooctyl-piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-cyclooctyl-1-(phenylmethyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-benzyl-4-cyclooctylpiperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-benzyl-4-cyclooctyl-piperazin-4-ium-2-yl]ethanol Formula: C21H35N2O+ MolecularWeight: 331.5154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH+]2CCN(C(C2)CCO)CC3=CC=CC=C3

Isomeric SMILES

C1CCCC(CCC1)[NH+]2CCN([C@H](C2)CCO)CC3=CC=CC=C3

InChI

InChI=1S/C21H34N2O/c24-16-13-21-18-23(20-11-7-2-1-3-8-12-20)15-14-22(21)17-19-9-5-4-6-10-19/h4-6,9-10,20-21,24H,1-3,7-8,11-18H2/p+1/t21-/m0/s1