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Amb22334712

Duplicate ID
Molecule Name 10-(1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
SmilesCOc1ccc(Cl)cc1NC(=O)C1C2C(C3c4ccccc4C=CN13)C(=O)N(c1cc3OCOc3cc1)C2=O
InchiKeyXHCFUHUUMKFDJE-UHFFFAOYSA-N
InChi InChI=1S/C29H22ClN3O6/c1-37-20-8-6-16(30)12-19(20)31-27(34)26-24-23(25-18-5-3-2-4-15(18)10-11-32(25)26)28(35)33(29(24)36)17-7-9-21-22(13-17)39-14-38-21/h2-13,23-26H,14H2,1H3,(H,31,34)
Formula C29H22ClN3O6
Molecular weight 543.954
Rings 7
logP 4.3073
PSA 97.41
MR 149.658
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