CAS-64490-92-2

Molecular Formula: C15H18NNaO5


InChI: InChI=1/C15H15NO3.Na.2H2O/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18;;;/h3-8H,9H2,1-2H3,(H,17,18);;2*1H2/q;+1;;/p-1/fC15H14NO3.Na.2H2O/q-1;m;;

InChIKey: InChIKey=QQILXENAYPUNEA-MRGZELLDCX
SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)[O-].O.O.[Na+]

Names:
    CAS-64490-92-2
    NCGC00017129-01
    sodium 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate dihydrate

Registries:
    PubChem CID 656499
    PubChem ID 11113045