2-[(2S)-1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]piperidin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-[(5-bromanyl-2,4-dimethoxy-phenyl)methyl]piperidin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-[(5-bromo-2,4-dimethoxy-phenyl)methyl]piperidin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-[(5-bromo-2,4-dimethoxyphenyl)methyl]-2-piperidin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-[(5-bromo-2,4-dimethoxyphenyl)methyl]piperidin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(5-bromo-2,4-dimethoxy-benzyl)piperidin-1-ium-2-yl]ethanol Formula: C16H25BrNO3+ MolecularWeight: 359.2786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+]2CCCCC2CCO)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+]2CCCC[C@H]2CCO)Br)OC

InChI

InChI=1S/C16H24BrNO3/c1-20-15-10-16(21-2)14(17)9-12(15)11-18-7-4-3-5-13(18)6-8-19/h9-10,13,19H,3-8,11H2,1-2H3/p+1/t13-/m0/s1