Sodium phenylacetate (JAN/USAN)

Properties Image MNX_ID MNXM161196 reference keggD:D05867 formula C8H7NaO2 global charge 0 mol weight 158.132 InChIKey HZOREEUASZHZBI-UHFFFAOYSA-M InChI InChI=1S/C8H8O2.Na/c9-8(10)6-7-4-2-1-3-5-7;/h1-5H,6H2,(H,9,10);/q;+1/p-1 SMILES O=C([O-])CC1=CC=CC=C1.[Na+] MNX internals InChI (mnx) InChI=1/C8H8O2.Na/c9-8(10)6-7-4-2-1-3-5-7;/h1-5H,6H2,(H,9,10);/q;+1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:7]([CH2:6][C:8](=[O:9])[OH:10])[CH:5]=[CH:3]1.[Na+:11]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0