(Z)-4-hydroxy-4-oxo-but-2-enoate; [2-(4-methylsulfanylphenoxy)ethylamino]azanium
Molecular Formula:
C
13
H
18
N
2
O
5
S
InChI:
InChI=1/C9H14N2OS.C4H4O4/c1-13-9-4-2-8(3-5-9)12-7-6-11-10;5-3(6)1-2-4(7)8/h2-5,11H,6-7,10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/fC9H15N2OS.C4H3O4/h10H;5H/q+1;-1
InChIKey:
InChIKey=RAGWKTIOTSOJMT-PFBSPBRIDR
SMILES:
CSC1=CC=C(C=C1)OCCN[NH3+].C(=CC(=O)[O-])C(=O)O
Names:
(Z)-4-hydroxy-4-oxo-but-2-enoate; [2-(4-methylsulfanylphenoxy)ethylamino]azanium
Registries:
PubChem CID 6435088
PubChem ID 11621299