methyl 2-[4-[(5-acetamido-4-fluoranyl-2-nitro-phenyl)amino]phenoxy]propanoate

Systemtic Name: methyl 2-[4-[(5-acetamido-4-fluoranyl-2-nitro-phenyl)amino]phenoxy]propanoate Openeye Name: methyl 2-[4-(5-acetamido-4-fluoro-2-nitro-anilino)phenoxy]propanoate CAS Name: 2-[4-(5-acetamido-4-fluoro-2-nitroanilino)phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[4-(5-acetamido-4-fluoro-2-nitroanilino)phenoxy]propanoate Traditional Name: 2-[4-(5-acetamido-4-fluoro-2-nitro-anilino)phenoxy]propionic acid methyl ester Formula: C18H18FN3O6 MolecularWeight: 391.350423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=CC=C(C=C1)NC2=CC(=C(C=C2[N+](=O)[O-])F)NC(=O)C

Isomeric SMILES

CC(C(=O)OC)OC1=CC=C(C=C1)NC2=CC(=C(C=C2[N+](=O)[O-])F)NC(=O)C

InChI

InChI=1S/C18H18FN3O6/c1-10(18(24)27-3)28-13-6-4-12(5-7-13)21-16-9-15(20-11(2)23)14(19)8-17(16)22(25)26/h4-10,21H,1-3H3,(H,20,23)