2-[2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoyl]-5-fluoranyl-4-morpholin-4-yl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoyl]-5-fluoranyl-4-morpholin-4-yl-phenoxy]ethanoic acid Openeye Name: 2-[2-[(4-bromo-2-fluoro-phenyl)methylcarbamoyl]-5-fluoro-4-morpholino-phenoxy]acetic acid CAS Name: 2-[2-[[(4-bromo-2-fluorophenyl)methylamino]-oxomethyl]-5-fluoro-4-(4-morpholinyl)phenoxy]acetic acid IUPAC Name: 2-[2-[(4-bromo-2-fluorophenyl)methylcarbamoyl]-5-fluoro-4-morpholin-4-ylphenoxy]acetic acid Traditional Name: 2-[2-[(4-bromo-2-fluoro-benzyl)carbamoyl]-5-fluoro-4-morpholino-phenoxy]acetic acid Formula: C20H19BrF2N2O5 MolecularWeight: 485.276066

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C(=C2)C(=O)NCC3=C(C=C(C=C3)Br)F)OCC(=O)O)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C(=C2)C(=O)NCC3=C(C=C(C=C3)Br)F)OCC(=O)O)F

InChI

InChI=1S/C20H19BrF2N2O5/c21-13-2-1-12(15(22)7-13)10-24-20(28)14-8-17(25-3-5-29-6-4-25)16(23)9-18(14)30-11-19(26)27/h1-2,7-9H,3-6,10-11H2,(H,24,28)(H,26,27)