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2-[(3S)-1-(furan-3-ylmethyl)piperidin-1-ium-3-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
2-[(3S)-1-(furan-3-ylmethyl)piperidin-1-ium-3-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C2CN(CCC2=C1)C3CCC[NH+](C3)CC4=COC=C4)OC
Isomeric SMILES
COC1=C(C=C2CN(CCC2=C1)[C@H]3CCC[NH+](C3)CC4=COC=C4)OC
InChI
InChI=1S/C21H28N2O3/c1-24-20-10-17-5-8-23(13-18(17)11-21(20)25-2)19-4-3-7-22(14-19)12-16-6-9-26-15-16/h6,9-11,15,19H,3-5,7-8,12-14H2,1-2H3/p+1/t19-/m0/s1
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