2-[[3,5-bis(bromanyl)-2-ethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3,5-bis(bromanyl)-2-ethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[3,5-dibromo-2-ethyl-4-(4-hydroxy-3-isopropyl-phenoxy)benzoyl]amino]acetic acid CAS Name: 2-[[[3,5-dibromo-2-ethyl-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3,5-dibromo-2-ethyl-4-(4-hydroxy-3-propan-2-ylphenoxy)benzoyl]amino]acetic acid Traditional Name: 2-[[3,5-dibromo-2-ethyl-4-(4-hydroxy-3-isopropyl-phenoxy)benzoyl]amino]acetic acid Formula: C20H21Br2NO5 MolecularWeight: 515.19244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1C(=O)NCC(=O)O)Br)OC2=CC(=C(C=C2)O)C(C)C)Br

Isomeric SMILES

CCC1=C(C(=C(C=C1C(=O)NCC(=O)O)Br)OC2=CC(=C(C=C2)O)C(C)C)Br

InChI

InChI=1S/C20H21Br2NO5/c1-4-12-14(20(27)23-9-17(25)26)8-15(21)19(18(12)22)28-11-5-6-16(24)13(7-11)10(2)3/h5-8,10,24H,4,9H2,1-3H3,(H,23,27)(H,25,26)