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sodium 2-[4-[(2-oxidanylidenecyclopentyl)methyl]phenyl]propanoate dihydrate
sodium 2-[4-[(2-oxidanylidenecyclopentyl)methyl]phenyl]propanoate dihydrate
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Canonical SMILES:
CC(C1=CC=C(C=C1)CC2CCCC2=O)C(=O)[O-].O.O.[Na+]
Isomeric SMILES
CC(C1=CC=C(C=C1)CC2CCCC2=O)C(=O)[O-].O.O.[Na+]
InChI
InChI=1S/C15H18O3.Na.2H2O/c1-10(15(17)18)12-7-5-11(6-8-12)9-13-3-2-4-14(13)16;;;/h5-8,10,13H,2-4,9H2,1H3,(H,17,18);;2*1H2/q;+1;;/p-1

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