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2-[(2S)-4-(1,3-benzodioxol-4-ylmethyl)-1-[(5-methylfuran-2-yl)methyl]piperazin-1-ium-2-yl]ethanol
2-[(2S)-4-(1,3-benzodioxol-4-ylmethyl)-1-[(5-methylfuran-2-yl)methyl]piperazin-1-ium-2-yl]ethanol
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=C(O1)C[NH+]2CCN(CC2CCO)CC3=C4C(=CC=C3)OCO4
Isomeric SMILES
CC1=CC=C(O1)C[NH+]2CCN(C[C@@H]2CCO)CC3=C4C(=CC=C3)OCO4
InChI
InChI=1S/C20H26N2O4/c1-15-5-6-18(26-15)13-22-9-8-21(12-17(22)7-10-23)11-16-3-2-4-19-20(16)25-14-24-19/h2-6,17,23H,7-14H2,1H3/p+1/t17-/m0/s1
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- 1-[2-[2,5-bis(fluoranyl)phenyl]-5-methyl-1,3-oxazol-4-yl]-N-methyl-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]methanamine
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