Tolmetin sodium dihydrate[托美丁钠二水合物]

CAS Name

1H-Pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-, sodium salt, hydrate (1:1:2)

Molecular Formula

C₁₅H₁₅NO₃.2H₂O.Na

Other Names and Identifiers

InChI

InChI=1S/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

InChIKey

InChIKey=AMCYRKBALHFTGR-UHFFFAOYSA-N

SMILES

C(=O)(C=1N(C)C(CC(O)=O)=CC1)C2=CC=C(C)C=C2.[Na].O

Canonical SMILES

[Na].O=C(O)CC1=CC=C(C(=O)C2=CC=C(C=C2)C)N1C.O

Other Names for this Substance