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

Systemtic Name: 2-[[3,5-bis(bromanyl)-4-(2-ethanoyl-4-oxidanyl-5-propan-2-yl-phenoxy)phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(2-acetyl-4-hydroxy-5-isopropyl-phenoxy)-3,5-dibromo-anilino]-2-oxo-acetic acid CAS Name: 2-[4-(2-acetyl-4-hydroxy-5-propan-2-ylphenoxy)-3,5-dibromoanilino]-2-oxoacetic acid IUPAC Name: 2-[4-(2-acetyl-4-hydroxy-5-propan-2-ylphenoxy)-3,5-dibromoanilino]-2-oxoacetic acid Traditional Name: 2-[4-(2-acetyl-4-hydroxy-5-isopropyl-phenoxy)-3,5-dibromo-anilino]-2-keto-acetic acid Formula: C19H17Br2NO6 MolecularWeight: 515.14938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17Br2NO6/c1-8(2)11-7-16(12(9(3)23)6-15(11)24)28-17-13(20)4-10(5-14(17)21)22-18(25)19(26)27/h4-8,24H,1-3H3,(H,22,25)(H,26,27)