[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(4-fluoroanilino)-2-oxo-ethyl] 4-(4-nitroanilino)-4-oxo-butanoate CAS Name: 4-(4-nitroanilino)-4-oxobutanoic acid [2-(4-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoroanilino)-2-oxoethyl] 4-(4-nitroanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(4-nitroanilino)butyric acid [2-(4-fluoroanilino)-2-keto-ethyl] ester Formula: C18H16FN3O6 MolecularWeight: 389.334543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCC(=O)OCC(=O)NC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCC(=O)OCC(=O)NC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16FN3O6/c19-12-1-3-13(4-2-12)21-17(24)11-28-18(25)10-9-16(23)20-14-5-7-15(8-6-14)22(26)27/h1-8H,9-11H2,(H,20,23)(H,21,24)