2-bromanyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-6-methoxy-phenol

Systemtic Name: 2-bromanyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-6-methoxy-phenol Openeye Name: 2-bromo-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-6-methoxy-phenol CAS Name: 2-bromo-4-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-6-methoxyphenol IUPAC Name: 2-bromo-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-6-methoxyphenol Traditional Name: 2-bromo-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-6-methoxy-phenol Formula: C15H23BrNO2+ MolecularWeight: 329.25262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=CC(=C(C(=C2)Br)O)OC

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=CC(=C(C(=C2)Br)O)OC

InChI

InChI=1S/C15H22BrNO2/c1-3-12-6-4-5-7-17(12)10-11-8-13(16)15(18)14(9-11)19-2/h8-9,12,18H,3-7,10H2,1-2H3/p+1/t12-/m0/s1