2-[(2S)-4-[(3-cyclopentyloxyphenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(3-cyclopentyloxyphenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[[3-(cyclopentoxy)phenyl]methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(3-cyclopentyloxyphenyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(3-cyclopentyloxyphenyl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[3-(cyclopentoxy)benzyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C19H31N2O2+ MolecularWeight: 319.46164

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1CCO)CC2=CC(=CC=C2)OC3CCCC3

Isomeric SMILES

C[NH+]1CCN(C[C@@H]1CCO)CC2=CC(=CC=C2)OC3CCCC3

InChI

InChI=1S/C19H30N2O2/c1-20-10-11-21(15-17(20)9-12-22)14-16-5-4-8-19(13-16)23-18-6-2-3-7-18/h4-5,8,13,17-18,22H,2-3,6-7,9-12,14-15H2,1H3/p+1/t17-/m0/s1