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Amb21913415

Duplicate ID
Molecule Name 1-(4-chlorophenyl)-6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole acetate
SmilesCC(O)=O.COc1cc2c(cc1)[nH]c1C(NCCc21)c1ccc(Cl)cc1
InchiKeyVBAISSQNCUEBQV-UHFFFAOYSA-N
InChi InChI=1S/C18H17ClN2O.C2H4O2/c1-22-13-6-7-16-15(10-13)14-8-9-20-17(18(14)21-16)11-2-4-12(19)5-3-11;1-2(3)4/h2-7,10,17,20-21H,8-9H2,1H3;1H3,(H,3,4)
Formula C20H21ClN2O3
Molecular weight 372.845
Rings 4
logP 4.4847
PSA 74.35
MR 107.129
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