2-[bromanyl-[3-bromanyl-4-[4-oxidanyl-2-(phenylmethyl)-5-propan-2-yl-phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[bromanyl-[3-bromanyl-4-[4-oxidanyl-2-(phenylmethyl)-5-propan-2-yl-phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(2-benzyl-4-hydroxy-5-isopropyl-phenoxy)-N,3-dibromo-anilino]-2-oxo-acetic acid CAS Name: 2-[N,3-dibromo-4-[4-hydroxy-2-(phenylmethyl)-5-propan-2-ylphenoxy]anilino]-2-oxoacetic acid IUPAC Name: 2-[4-(2-benzyl-4-hydroxy-5-propan-2-ylphenoxy)-N,3-dibromoanilino]-2-oxoacetic acid Traditional Name: 2-[4-(2-benzyl-4-hydroxy-5-isopropyl-phenoxy)-N,3-dibromo-anilino]-2-keto-acetic acid Formula: C24H21Br2NO5 MolecularWeight: 563.23524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C(=C1)OC2=C(C=C(C=C2)N(C(=O)C(=O)O)Br)Br)CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)C1=C(C=C(C(=C1)OC2=C(C=C(C=C2)N(C(=O)C(=O)O)Br)Br)CC3=CC=CC=C3)O

InChI

InChI=1S/C24H21Br2NO5/c1-14(2)18-13-22(16(11-20(18)28)10-15-6-4-3-5-7-15)32-21-9-8-17(12-19(21)25)27(26)23(29)24(30)31/h3-9,11-14,28H,10H2,1-2H3,(H,30,31)