NSC81078
Molecular Formula:
C
13
H
11
Br
2
NO
6
InChI:
InChI=1/C13H11Br2NO6/c1-6-4-13(15,12(17)22-6)11(14)7-2-9-10(21-5-20-9)3-8(7)16(18)19/h2-3,6,11H,4-5H2,1H3
InChIKey:
InChIKey=BZHAOWSFRNKSBW-UHFFFAOYAI
SMILES:
CC1CC(C(=O)O1)(C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)Br)Br
Names:
NSC81078
3-bromo-3-[bromo-(6-nitrobenzo[1,3]dioxol-5-yl)methyl]-5-methyl-oxolan-2-one
Registries:
PubChem CID 255494
PubChem ID 120261