methyl 4-(1,2,2-tricyano-8-ethyl-7-imino-5-methyl-4,6-dioxabicyclo[3.2.1]oct-3-yl)benzoate
Molecular Formula:
C
20
H
18
N
4
O
4
InChI:
InChI=1/C20H18N4O4/c1-4-14-18(2)27-15(12-5-7-13(8-6-12)16(25)26-3)19(9-21,10-22)20(14,11-23)17(24)28-18/h5-8,14-15,24H,4H2,1-3H3/b24-17-
InChIKey:
InChIKey=AQUQSCVGQAGSAK-ULJHMMPZBU
SMILES:
CCC1C2(OC(C(C1(C(=N)O2)C#N)(C#N)C#N)C3=CC=C(C=C3)C(=O)OC)C
Names:
methyl 4-(1,2,2-tricyano-8-ethyl-7-imino-5-methyl-4,6-dioxabicyclo[3.2.1]oct-3-yl)benzoate
Registries:
PubChem CID 4475252
PubChem ID 6596048
