3-fluoro-5-(((3aR,7aS)-hexahydro-1H-isoindol-2(3H)-yl)sulfonyl)benzoic acid
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Basic information
GHS | |
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Exact Mass | 327.09406 |
Smiles | S(=O)(=O)(N1C[C@]2([H])[C@](CCCC2)([H])C1)C1=CC(C(O)=O)=CC(F)=C1 |
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Canonical Smiles | OC(=O)C1C=C(C=C(F)C=1)S(=O)(=O)N1C[C@@H]2CCCC[C@@H]2C1 |
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Inchi | InChI=1S/C15H18FNO4S/c16-13-5-12(15(18)19)6-14(7-13)22(20,21)17-8-10-3-1-2-4-11(10)9-17/h5-7,10-11H,1-4,8-9H2,(H,18,19)/t10-,11+ |
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InchiKey | ARPVSAJRSSOGOR-PHIMTYICSA-N |
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