tris[(4-nitrophenyl)methyl] phosphate

Systemtic Name: tris[(4-nitrophenyl)methyl] phosphate Openeye Name: tris[(4-nitrophenyl)methyl] phosphate CAS Name: phosphoric acid tris[(4-nitrophenyl)methyl] ester IUPAC Name: tris[(4-nitrophenyl)methyl] phosphate Traditional Name: phosphoric acid tris(4-nitrobenzyl) ester Formula: C21H18N3O10P MolecularWeight: 503.355481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COP(=O)(OCC2=CC=C(C=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COP(=O)(OCC2=CC=C(C=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H18N3O10P/c25-22(26)19-7-1-16(2-8-19)13-32-35(31,33-14-17-3-9-20(10-4-17)23(27)28)34-15-18-5-11-21(12-6-18)24(29)30/h1-12H,13-15H2