1-pyridin-1-yl-3-(2,4,6-trinitrophenoxy)propan-2-ol; 2,4,6-trinitrophenolate
Molecular Formula:
C
20
H
15
N
7
O
15
InChI:
InChI=1/C14H13N4O8.C6H3N3O7/c19-11(8-15-4-2-1-3-5-15)9-26-14-12(17(22)23)6-10(16(20)21)7-13(14)18(24)25;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-7,11,19H,8-9H2;1-2,10H/q+1;/p-1/fC14H13N4O8.C6H2N3O7/h;10h/qm;-1
InChIKey:
InChIKey=ICLXAHGTYHGKLC-IKFCUCGLCR
SMILES:
C1=CC=[N+](C=C1)CC(COC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])O.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]
Names:
1-pyridin-1-yl-3-(2,4,6-trinitrophenoxy)propan-2-ol; 2,4,6-trinitrophenolate
Registries:
PubChem CID 2827617
PubChem ID 11564097
