9-[5-[[dimethyl(3-phenoxypropyl)azaniumyl]methyl]-1,3-oxazol-2-yl]fluoren-9-olate

Systemtic Name: 9-[5-[[dimethyl(3-phenoxypropyl)azaniumyl]methyl]-1,3-oxazol-2-yl]fluoren-9-olate Openeye Name: 9-[5-[[dimethyl(3-phenoxypropyl)ammonio]methyl]oxazol-2-yl]fluoren-9-olate CAS Name: 9-[5-[[dimethyl(3-phenoxypropyl)ammonio]methyl]-2-oxazolyl]-9-fluorenolate IUPAC Name: 9-[5-[[dimethyl(3-phenoxypropyl)azaniumyl]methyl]-1,3-oxazol-2-yl]fluoren-9-olate Traditional Name: 9-[5-[[dimethyl(3-phenoxypropyl)ammonio]methyl]oxazol-2-yl]fluoren-9-olate Formula: C28H28N2O3 MolecularWeight: 440.53352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCOC1=CC=CC=C1)CC2=CN=C(O2)C3(C4=CC=CC=C4C5=CC=CC=C53)[O-]

Isomeric SMILES

C[N+](C)(CCCOC1=CC=CC=C1)CC2=CN=C(O2)C3(C4=CC=CC=C4C5=CC=CC=C53)[O-]

InChI

InChI=1S/C28H28N2O3/c1-30(2,17-10-18-32-21-11-4-3-5-12-21)20-22-19-29-27(33-22)28(31)25-15-8-6-13-23(25)24-14-7-9-16-26(24)28/h3-9,11-16,19H,10,17-18,20H2,1-2H3