dimethyl-[2-[(4-methylphenyl)-phenyl-methoxy]ethyl]azanium; (Z)-4-hydroxy-4-oxo-but-2-enoate
Molecular Formula:
C
22
H
27
NO
5
InChI:
InChI=1/C18H23NO.C4H4O4/c1-15-9-11-17(12-10-15)18(20-14-13-19(2)3)16-7-5-4-6-8-16;5-3(6)1-2-4(7)8/h4-12,18H,13-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/fC18H24NO.C4H3O4/h19H;5H/q+1;-1
InChIKey:
InChIKey=ZEMCWEKFOJVERM-MJYJBOGYDC
SMILES:
CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC[NH+](C)C.C(=CC(=O)[O-])C(=O)O
Names:
dimethyl-[2-[(4-methylphenyl)-phenyl-methoxy]ethyl]azanium; (Z)-4-hydroxy-4-oxo-but-2-enoate
Registries:
PubChem CID 6435588
PubChem ID 11621516