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Benafentrine

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For Research Use Only | Not For Clinical Use
CATAPS35135014
CAS35135-01-4
Structure
IUPAC NameN-[4-[(4aS,10bR)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide
Molecular Weight393.48
Molecular FormulaC23H27N3O3
Canonical SMILESCOc1cc2[C@@H]3CN(C)CC[C@@H]3N=C(c4ccc(NC(=O)C)cc4)c2cc1OC
InChIInChI=1S/C23H27N3O3/c1-14(27)24-16-7-5-15(6-8-16)23-18-12-22(29-4)21(28-3)11-17(18)19-13-26(2)10-9-20(19)25-23/h5-8,11-12,19-20H,9-10,13H2,1-4H3,(H,24,27)/t19-,20-/m0/s1
Accurate Mass393.2052
FormatNeat
SubcategoryChiral molecules
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