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

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[(3-methoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[(3-methoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[(3-methoxyphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[(3-methoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-m-anisyl-piperazin-1-ium-2-yl]ethanol Formula: C20H33N2O2+ MolecularWeight: 333.48822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CC[NH+](C(C2)CCO)C3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)CN2CC[NH+]([C@H](C2)CCO)C3CCCCC3

InChI

InChI=1S/C20H32N2O2/c1-24-20-9-5-6-17(14-20)15-21-11-12-22(19(16-21)10-13-23)18-7-3-2-4-8-18/h5-6,9,14,18-19,23H,2-4,7-8,10-13,15-16H2,1H3/p+1/t19-/m0/s1