U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H21HgO.C2H3O2
Molecular Weight 464.95
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETOMEROCTOL

SMILES

CC([O-])=O.CC(C)(C)CC(C)(C)C1=CC=C(O)C([Hg+])=C1

InChI

InChIKey=YEWQCWVEXRSMSB-UHFFFAOYSA-M
InChI=1S/C14H21O.C2H4O2.Hg/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11;1-2(3)4;/h6-8,15H,10H2,1-5H3;1H3,(H,3,4);/q;;+1/p-1

HIDE SMILES / InChI

Approval Year