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2-[(3-ethoxycarbonyl-5-methoxy-1-benzofuran-2-yl)methylsulfanyl]ethyl-diethyl-azanium chloride hydrate
2-[(3-ethoxycarbonyl-5-methoxy-1-benzofuran-2-yl)methylsulfanyl]ethyl-diethyl-azanium chloride hydrate
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Canonical SMILES:
CC[NH+](CC)CCSCC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)OCC.O.[Cl-]
Isomeric SMILES
CC[NH+](CC)CCSCC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)OCC.O.[Cl-]
InChI
InChI=1S/C19H27NO4S.ClH.H2O/c1-5-20(6-2)10-11-25-13-17-18(19(21)23-7-3)15-12-14(22-4)8-9-16(15)24-17;;/h8-9,12H,5-7,10-11,13H2,1-4H3;1H;1H2
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