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

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-benzamido-3-phenyl-propanoate Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl] 2-benzamido-3-phenyl-propanoate CAS Name: 2-benzamido-3-phenylpropanoic acid [2-(4-bromo-2-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 2-benzamido-3-phenylpropanoate Traditional Name: 2-benzamido-3-phenyl-propionic acid [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl] ester Formula: C24H20BrFN2O4 MolecularWeight: 499.329003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)F)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)F)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H20BrFN2O4/c25-18-11-12-20(19(26)14-18)27-22(29)15-32-24(31)21(13-16-7-3-1-4-8-16)28-23(30)17-9-5-2-6-10-17/h1-12,14,21H,13,15H2,(H,27,29)(H,28,30)