3-bromanyl-4-[2-[4-chloranyl-2-(3-cyclopropyl-5-fluoranyl-phenyl)carbonyl-phenoxy]ethanoylamino]benzoic acid

Systemtic Name: 3-bromanyl-4-[2-[4-chloranyl-2-(3-cyclopropyl-5-fluoranyl-phenyl)carbonyl-phenoxy]ethanoylamino]benzoic acid Openeye Name: 3-bromo-4-[[2-[4-chloro-2-(3-cyclopropyl-5-fluoro-benzoyl)phenoxy]acetyl]amino]benzoic acid CAS Name: 3-bromo-4-[[2-[4-chloro-2-[(3-cyclopropyl-5-fluorophenyl)-oxomethyl]phenoxy]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-bromo-4-[[2-[4-chloro-2-(3-cyclopropyl-5-fluorobenzoyl)phenoxy]acetyl]amino]benzoic acid Traditional Name: 3-bromo-4-[[2-[4-chloro-2-(3-cyclopropyl-5-fluoro-benzoyl)phenoxy]acetyl]amino]benzoic acid Formula: C25H18BrClFNO5 MolecularWeight: 546.769523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=CC(=C2)C(=O)C3=C(C=CC(=C3)Cl)OCC(=O)NC4=C(C=C(C=C4)C(=O)O)Br)F

Isomeric SMILES

C1CC1C2=CC(=CC(=C2)C(=O)C3=C(C=CC(=C3)Cl)OCC(=O)NC4=C(C=C(C=C4)C(=O)O)Br)F

InChI

InChI=1S/C25H18BrClFNO5/c26-20-10-14(25(32)33)3-5-21(20)29-23(30)12-34-22-6-4-17(27)11-19(22)24(31)16-7-15(13-1-2-13)8-18(28)9-16/h3-11,13H,1-2,12H2,(H,29,30)(H,32,33)