ethyl 3-[3-(2-fluoranyl-4-phenyl-phenyl)propanoylamino]-4-nitro-benzoate

Systemtic Name: ethyl 3-[3-(2-fluoranyl-4-phenyl-phenyl)propanoylamino]-4-nitro-benzoate Openeye Name: ethyl 3-[3-(2-fluoro-4-phenyl-phenyl)propanoylamino]-4-nitro-benzoate CAS Name: 3-[[3-(2-fluoro-4-phenylphenyl)-1-oxopropyl]amino]-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(2-fluoro-4-phenylphenyl)propanoylamino]-4-nitrobenzoate Traditional Name: 3-[3-(2-fluoro-4-phenyl-phenyl)propanoylamino]-4-nitro-benzoic acid ethyl ester Formula: C24H21FN2O5 MolecularWeight: 436.432343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CCC2=C(C=C(C=C2)C3=CC=CC=C3)F

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CCC2=C(C=C(C=C2)C3=CC=CC=C3)F

InChI

InChI=1S/C24H21FN2O5/c1-2-32-24(29)19-10-12-22(27(30)31)21(15-19)26-23(28)13-11-17-8-9-18(14-20(17)25)16-6-4-3-5-7-16/h3-10,12,14-15H,2,11,13H2,1H3,(H,26,28)