(7R,14R)-11-(7-amino-6,7-dihydro-7-methyl-5H-cyclopenta[b]pyridin-3-yl)-1-(difluoromethoxy)-10-fluoro-6,7-dihydro-6-methyl-7,14-methanobenzimidazo[1,2-b][2,5]benzodiazocin-5(14H)--one formate
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Basic information
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Exact Mass | 565.19369 |
Smiles | C(=O)O.O(C1C=CC=C2C=1[C@@]1([H])C[C@@]([H])(N(C2=O)C)C2=NC3C(=CC(C4C=C5CCC(N)(C)C5=NC=4)=C(C=3)F)N12)C(F)F |
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Canonical Smiles | CN1[C@@H]2C[C@H](C3C(=CC=CC=3OC(F)F)C1=O)N1C2=NC2=CC(F)=C(C=C12)C1C=C2CCC(C)(N)C2=NC=1.OC=O |
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Inchi | InChI=1S/C28H24F3N5O2.CH2O2/c1-28(32)7-6-13-8-14(12-33-24(13)28)16-9-19-18(10-17(16)29)34-25-21-11-20(36(19)25)23-15(26(37)35(21)2)4-3-5-22(23)38-27(30)31;2-1-3/h3-5,8-10,12,20-21,27H,6-7,11,32H2,1-2H3;1H,(H,2,3)/t20-,21-,28?;/m1./s1 |
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InchiKey | MPSMNEIEEMKKQZ-ABVMEFPJSA-N |
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