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

Systemtic Name: 2-[[3,5-bis(bromanyl)-4-(3-methyl-4-oxidanyl-5-propan-2-yl-phenoxy)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[3,5-dibromo-4-(4-hydroxy-3-isopropyl-5-methyl-phenoxy)benzoyl]amino]acetic acid CAS Name: 2-[[[3,5-dibromo-4-(4-hydroxy-3-methyl-5-propan-2-ylphenoxy)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3,5-dibromo-4-(4-hydroxy-3-methyl-5-propan-2-ylphenoxy)benzoyl]amino]acetic acid Traditional Name: 2-[[3,5-dibromo-4-(4-hydroxy-3-isopropyl-5-methyl-phenoxy)benzoyl]amino]acetic acid Formula: C19H19Br2NO5 MolecularWeight: 501.16586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C(C)C)OC2=C(C=C(C=C2Br)C(=O)NCC(=O)O)Br

Isomeric SMILES

CC1=CC(=CC(=C1O)C(C)C)OC2=C(C=C(C=C2Br)C(=O)NCC(=O)O)Br

InChI

InChI=1S/C19H19Br2NO5/c1-9(2)13-7-12(4-10(3)17(13)25)27-18-14(20)5-11(6-15(18)21)19(26)22-8-16(23)24/h4-7,9,25H,8H2,1-3H3,(H,22,26)(H,23,24)