ethyl 2-[[(4-aminocarbonyl-2-nitro-phenyl)amino]methyl]-3-(4-fluorophenyl)propanoate

Systemtic Name: ethyl 2-[[(4-aminocarbonyl-2-nitro-phenyl)amino]methyl]-3-(4-fluorophenyl)propanoate Openeye Name: ethyl 2-[(4-carbamoyl-2-nitro-anilino)methyl]-3-(4-fluorophenyl)propanoate CAS Name: 2-[(4-carbamoyl-2-nitroanilino)methyl]-3-(4-fluorophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-carbamoyl-2-nitroanilino)methyl]-3-(4-fluorophenyl)propanoate Traditional Name: 2-[(4-carbamoyl-2-nitro-anilino)methyl]-3-(4-fluorophenyl)propionic acid ethyl ester Formula: C19H20FN3O5 MolecularWeight: 389.377603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)F)CNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)F)CNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H20FN3O5/c1-2-28-19(25)14(9-12-3-6-15(20)7-4-12)11-22-16-8-5-13(18(21)24)10-17(16)23(26)27/h3-8,10,14,22H,2,9,11H2,1H3,(H2,21,24)