6-methoxy-2-methyl-1-(2-methylpropyl)-3,4-dihydro-1H-isoquinolin-7-ol; 2,4,6-trinitrophenolate
Molecular Formula:
C
21
H
26
N
4
O
9
InChI:
InChI=1/C15H23NO2.C6H3N3O7/c1-10(2)7-13-12-9-14(17)15(18-4)8-11(12)5-6-16(13)3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h8-10,13,17H,5-7H2,1-4H3;1-2,10H/fC15H24NO2.C6H2N3O7/h16H;10h/q+1;-1
InChIKey:
InChIKey=MLDQZIQHGCUYQX-LWUCPKSTCH
SMILES:
CC(C)CC1C2=CC(=C(C=C2CC[NH+]1C)OC)O.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]
Names:
6-methoxy-2-methyl-1-(2-methylpropyl)-3,4-dihydro-1H-isoquinolin-7-ol; 2,4,6-trinitrophenolate
Registries:
PubChem CID 2752209
PubChem ID 11564033
