methyl 2-[2-[(5-bromanyl-2-ethanoyl-4-fluoranyl-phenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(5-bromanyl-2-ethanoyl-4-fluoranyl-phenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(2-acetyl-5-bromo-4-fluoro-anilino)acetyl]amino]benzoate CAS Name: 2-[[2-(2-acetyl-5-bromo-4-fluoroanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-acetyl-5-bromo-4-fluoroanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(2-acetyl-5-bromo-4-fluoro-anilino)acetyl]amino]benzoic acid methyl ester Formula: C18H16BrFN2O4 MolecularWeight: 423.233043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1NCC(=O)NC2=CC=CC=C2C(=O)OC)Br)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1NCC(=O)NC2=CC=CC=C2C(=O)OC)Br)F

InChI

InChI=1S/C18H16BrFN2O4/c1-10(23)12-7-14(20)13(19)8-16(12)21-9-17(24)22-15-6-4-3-5-11(15)18(25)26-2/h3-8,21H,9H2,1-2H3,(H,22,24)