acetamido 2-[[4-(2-fluorophenyl)phenyl]methyl]-4-nitro-benzoate

Systemtic Name: acetamido 2-[[4-(2-fluorophenyl)phenyl]methyl]-4-nitro-benzoate Openeye Name: acetamido 2-[[4-(2-fluorophenyl)phenyl]methyl]-4-nitro-benzoate CAS Name: 2-[[4-(2-fluorophenyl)phenyl]methyl]-4-nitrobenzoic acid acetamido ester IUPAC Name: acetamido 2-[[4-(2-fluorophenyl)phenyl]methyl]-4-nitrobenzoate Traditional Name: 2-[4-(2-fluorophenyl)benzyl]-4-nitro-benzoic acid acetamido ester Formula: C22H17FN2O5 MolecularWeight: 408.379183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NOC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])CC2=CC=C(C=C2)C3=CC=CC=C3F

Isomeric SMILES

CC(=O)NOC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])CC2=CC=C(C=C2)C3=CC=CC=C3F

InChI

InChI=1S/C22H17FN2O5/c1-14(26)24-30-22(27)20-11-10-18(25(28)29)13-17(20)12-15-6-8-16(9-7-15)19-4-2-3-5-21(19)23/h2-11,13H,12H2,1H3,(H,24,26)