2-[2-[(4-bromophenyl)methyl-fluoranyl-carbamoyl]-5-fluoranyl-4-morpholin-4-yl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(4-bromophenyl)methyl-fluoranyl-carbamoyl]-5-fluoranyl-4-morpholin-4-yl-phenoxy]ethanoic acid Openeye Name: 2-[2-[(4-bromophenyl)methyl-fluoro-carbamoyl]-5-fluoro-4-morpholino-phenoxy]acetic acid CAS Name: 2-[2-[[(4-bromophenyl)methyl-fluoroamino]-oxomethyl]-5-fluoro-4-(4-morpholinyl)phenoxy]acetic acid IUPAC Name: 2-[2-[(4-bromophenyl)methyl-fluorocarbamoyl]-5-fluoro-4-morpholin-4-ylphenoxy]acetic acid Traditional Name: 2-[2-[(4-bromobenzyl)-fluoro-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)N(CC3=CC=C(C=C3)Br)F)OCC(=O)O)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C(=C2)C(=O)N(CC3=CC=C(C=C3)Br)F)OCC(=O)O)F

InChI

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