2-[[4-[(E)-2-(4-nitrophenyl)ethenyl]phenoxy]methyl]propane-1,3-diol

Systemtic Name: 2-[[4-[(E)-2-(4-nitrophenyl)ethenyl]phenoxy]methyl]propane-1,3-diol Openeye Name: 2-[[4-[(E)-2-(4-nitrophenyl)vinyl]phenoxy]methyl]propane-1,3-diol CAS Name: 2-[[4-[(E)-2-(4-nitrophenyl)ethenyl]phenoxy]methyl]propane-1,3-diol IUPAC Name: 2-[[4-[(E)-2-(4-nitrophenyl)ethenyl]phenoxy]methyl]propane-1,3-diol Traditional Name: 2-[[4-[(E)-2-(4-nitrophenyl)vinyl]phenoxy]methyl]propane-1,3-diol Formula: C18H19NO5 MolecularWeight: 329.34716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC=C(C=C2)OCC(CO)CO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)OCC(CO)CO)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO5/c20-11-16(12-21)13-24-18-9-5-15(6-10-18)2-1-14-3-7-17(8-4-14)19(22)23/h1-10,16,20-21H,11-13H2/b2-1+