[[1-methoxy-3-oxidanylidene-1-phenyl-3-(2,4,6-trimethoxyphenyl)propan-2-yl]-nitrooxy-thallanyl] nitrate

Systemtic Name: [[1-methoxy-3-oxidanylidene-1-phenyl-3-(2,4,6-trimethoxyphenyl)propan-2-yl]-nitrooxy-thallanyl] nitrate Openeye Name: [[1-[methoxy(phenyl)methyl]-2-oxo-2-(2,4,6-trimethoxyphenyl)ethyl]-nitrooxy-thallanyl] nitrate CAS Name: nitric acid [[1-methoxy-3-oxo-1-phenyl-3-(2,4,6-trimethoxyphenyl)propan-2-yl]-nitrooxythallanyl] ester IUPAC Name: [[1-methoxy-3-oxo-1-phenyl-3-(2,4,6-trimethoxyphenyl)propan-2-yl]-nitrooxythallanyl] nitrate Traditional Name: nitric acid [[2-keto-1-[methoxy(phenyl)methyl]-2-(2,4,6-trimethoxyphenyl)ethyl]-nitrooxy-thallanyl] ester Formula: C19H21N2O11Tl MolecularWeight: 657.76014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)C(=O)C(C(C2=CC=CC=C2)OC)[Tl](O[N+](=O)[O-])O[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)C(=O)C(C(C2=CC=CC=C2)OC)[Tl](O[N+](=O)[O-])O[N+](=O)[O-])OC

InChI

InChI=1S/C19H21O5.2NO3.Tl/c1-21-14-10-17(23-3)19(18(11-14)24-4)15(20)12-16(22-2)13-8-6-5-7-9-13;2*2-1(3)4;/h5-12,16H,1-4H3;;;/q;2*-1;+2