2-[4-azanyl-2-[2-(4-bromanyl-2-fluoranyl-phenyl)ethanoylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-azanyl-2-[2-(4-bromanyl-2-fluoranyl-phenyl)ethanoylamino]phenoxy]ethanoic acid Openeye Name: 2-[4-amino-2-[[2-(4-bromo-2-fluoro-phenyl)acetyl]amino]phenoxy]acetic acid CAS Name: 2-[4-amino-2-[[2-(4-bromo-2-fluorophenyl)-1-oxoethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[4-amino-2-[[2-(4-bromo-2-fluorophenyl)acetyl]amino]phenoxy]acetic acid Traditional Name: 2-[4-amino-2-[[2-(4-bromo-2-fluoro-phenyl)acetyl]amino]phenoxy]acetic acid Formula: C16H14BrFN2O4 MolecularWeight: 397.195763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)NC(=O)CC2=C(C=C(C=C2)Br)F)OCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)NC(=O)CC2=C(C=C(C=C2)Br)F)OCC(=O)O

InChI

InChI=1S/C16H14BrFN2O4/c17-10-2-1-9(12(18)6-10)5-15(21)20-13-7-11(19)3-4-14(13)24-8-16(22)23/h1-4,6-7H,5,8,19H2,(H,20,21)(H,22,23)