[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-benzamido-3-phenyl-propanoate

Systemtic Name: [2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-benzamido-3-phenyl-propanoate Openeye Name: [2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl] 2-benzamido-3-phenyl-propanoate CAS Name: 2-benzamido-3-phenylpropanoic acid [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 2-benzamido-3-phenylpropanoate Traditional Name: 2-benzamido-3-phenyl-propionic acid [2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C24H20FN3O6 MolecularWeight: 465.430503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H20FN3O6/c25-19-12-11-18(14-21(19)28(32)33)26-22(29)15-34-24(31)20(13-16-7-3-1-4-8-16)27-23(30)17-9-5-2-6-10-17/h1-12,14,20H,13,15H2,(H,26,29)(H,27,30)