[(4,4-dimethoxy-2-phenyl-2,3-dihydrochromen-3-yl)-nitrooxy-thallanyl] nitrate

Systemtic Name: [(4,4-dimethoxy-2-phenyl-2,3-dihydrochromen-3-yl)-nitrooxy-thallanyl] nitrate Openeye Name: [(4,4-dimethoxy-2-phenyl-chroman-3-yl)-nitrooxy-thallanyl] nitrate CAS Name: nitric acid [(4,4-dimethoxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-3-yl)-nitrooxythallanyl] ester IUPAC Name: [(4,4-dimethoxy-2-phenyl-2,3-dihydrochromen-3-yl)-nitrooxythallanyl] nitrate Traditional Name: nitric acid [(4,4-dimethoxy-2-phenyl-chroman-3-yl)-nitrooxy-thallanyl] ester Formula: C17H17N2O9Tl MolecularWeight: 597.70818

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(C(OC2=CC=CC=C21)C3=CC=CC=C3)[Tl](O[N+](=O)[O-])O[N+](=O)[O-])OC

Isomeric SMILES

COC1(C(C(OC2=CC=CC=C21)C3=CC=CC=C3)[Tl](O[N+](=O)[O-])O[N+](=O)[O-])OC

InChI

InChI=1S/C17H17O3.2NO3.Tl/c1-18-17(19-2)12-16(13-8-4-3-5-9-13)20-15-11-7-6-10-14(15)17;2*2-1(3)4;/h3-12,16H,1-2H3;;;/q;2*-1;+2