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

Systemtic Name: 2-[[3,5-bis(bromanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]carbonylamino]-2-methyl-3-phenyl-propanoic acid Openeye Name: 2-[[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)benzoyl]amino]-2-methyl-3-phenyl-propanoic acid CAS Name: 2-[[[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)phenyl]-oxomethyl]amino]-2-methyl-3-phenylpropanoic acid IUPAC Name: 2-[[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)benzoyl]amino]-2-methyl-3-phenylpropanoic acid Traditional Name: 2-[[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)benzoyl]amino]-2-methyl-3-phenyl-propionic acid Formula: C26H25Br2NO5 MolecularWeight: 591.2884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)C(=O)NC(C)(CC3=CC=CC=C3)C(=O)O)Br)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)C(=O)NC(C)(CC3=CC=CC=C3)C(=O)O)Br)O

InChI

InChI=1S/C26H25Br2NO5/c1-15(2)19-13-18(9-10-22(19)30)34-23-20(27)11-17(12-21(23)28)24(31)29-26(3,25(32)33)14-16-7-5-4-6-8-16/h4-13,15,30H,14H2,1-3H3,(H,29,31)(H,32,33)