(Z)-4-hydroxy-4-oxo-but-2-enoate; [2-(4-methoxyphenyl)sulfanylethylamino]azanium
Molecular Formula:
C
13
H
18
N
2
O
5
S
InChI:
InChI=1/C9H14N2OS.C4H4O4/c1-12-8-2-4-9(5-3-8)13-7-6-11-10;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=PAPPBNIPUAYHCQ-PFBSPBRIDV
SMILES:
COC1=CC=C(C=C1)SCCN[NH3+].C(=CC(=O)[O-])C(=O)O
Names:
(Z)-4-hydroxy-4-oxo-but-2-enoate; [2-(4-methoxyphenyl)sulfanylethylamino]azanium
Registries:
PubChem CID 6435107
PubChem ID 11621312