2,2-bis[(4-nitrophenyl)methyl]propane-1,3-diol

Systemtic Name: 2,2-bis[(4-nitrophenyl)methyl]propane-1,3-diol Openeye Name: 2,2-bis[(4-nitrophenyl)methyl]propane-1,3-diol CAS Name: 2,2-bis[(4-nitrophenyl)methyl]propane-1,3-diol IUPAC Name: 2,2-bis[(4-nitrophenyl)methyl]propane-1,3-diol Traditional Name: 2,2-bis(4-nitrobenzyl)propane-1,3-diol Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CC2=CC=C(C=C2)[N+](=O)[O-])(CO)CO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(CC2=CC=C(C=C2)[N+](=O)[O-])(CO)CO)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O6/c20-11-17(12-21,9-13-1-5-15(6-2-13)18(22)23)10-14-3-7-16(8-4-14)19(24)25/h1-8,20-21H,9-12H2