6-methoxy-2-methyl-1-(2-methylpropyl)-7-phenylmethoxy-3,4-dihydro-1H-isoquinoline; 2,4,6-trinitrophenolate

Molecular Formula: C28H32N4O9


InChI: InChI=1/C22H29NO2.C6H3N3O7/c1-16(2)12-20-19-14-22(25-15-17-8-6-5-7-9-17)21(24-4)13-18(19)10-11-23(20)3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5-9,13-14,16,20H,10-12,15H2,1-4H3;1-2,10H/fC22H30NO2.C6H2N3O7/h23H;10h/q+1;-1

InChIKey: InChIKey=IKILDPHCPZKZBY-WGMPSJCYCH
SMILES: CC(C)CC1C2=CC(=C(C=C2CC[NH+]1C)OC)OCC3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Names:
    6-methoxy-2-methyl-1-(2-methylpropyl)-7-phenylmethoxy-3,4-dihydro-1H-isoquinoline; 2,4,6-trinitrophenolate

Registries:
    PubChem CID 2752222
    PubChem ID 11564036