[3,4-bis(fluoranyl)phenyl] 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: [3,4-bis(fluoranyl)phenyl] 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: (3,4-difluorophenyl) 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid (3,4-difluorophenyl) ester IUPAC Name: (3,4-difluorophenyl) 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid (3,4-difluorophenyl) ester Formula: C16H12F2N2O5 MolecularWeight: 350.273686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)OC2=CC(=C(C=C2)F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)OC2=CC(=C(C=C2)F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H12F2N2O5/c17-13-6-5-12(9-14(13)18)25-15(21)7-8-19-16(22)10-1-3-11(4-2-10)20(23)24/h1-6,9H,7-8H2,(H,19,22)