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

Systemtic Name: 2-[(2S)-1-cyclohexyl-4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclohexyl-4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclohexyl-4-[(2,4-dimethoxy-3-methylphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclohexyl-4-[(2,4-dimethoxy-3-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclohexyl-4-(2,4-dimethoxy-3-methyl-benzyl)piperazin-1-ium-2-yl]ethanol Formula: C22H37N2O3+ MolecularWeight: 377.54078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)CN2CC[NH+](C(C2)CCO)C3CCCCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)CN2CC[NH+]([C@H](C2)CCO)C3CCCCC3)OC

InChI

InChI=1S/C22H36N2O3/c1-17-21(26-2)10-9-18(22(17)27-3)15-23-12-13-24(20(16-23)11-14-25)19-7-5-4-6-8-19/h9-10,19-20,25H,4-8,11-16H2,1-3H3/p+1/t20-/m0/s1