2-[(2S)-1-cyclohexyl-4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[(4-methoxy-2,5-dimethylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-(4-methoxy-2,5-dimethyl-benzyl)piperazin-1-ium-2-yl]ethanol Formula: C22H37N2O2+ MolecularWeight: 361.54138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CC[NH+](C(C2)CCO)C3CCCCC3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CC[NH+]([C@H](C2)CCO)C3CCCCC3)C)OC

InChI

InChI=1S/C22H36N2O2/c1-17-14-22(26-3)18(2)13-19(17)15-23-10-11-24(21(16-23)9-12-25)20-7-5-4-6-8-20/h13-14,20-21,25H,4-12,15-16H2,1-3H3/p+1/t21-/m0/s1