2-[4-bromanyl-2-[[4-(4-phenylbutoxy)phenyl]carbonylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-bromanyl-2-[[4-(4-phenylbutoxy)phenyl]carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[[4-(4-phenylbutoxy)benzoyl]amino]phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[[oxo-[4-(4-phenylbutoxy)phenyl]methyl]amino]phenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[[4-(4-phenylbutoxy)benzoyl]amino]phenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[[4-(4-phenylbutoxy)benzoyl]amino]phenoxy]acetic acid Formula: C25H24BrNO5 MolecularWeight: 498.36576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Br)OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Br)OCC(=O)O

InChI

InChI=1S/C25H24BrNO5/c26-20-11-14-23(32-17-24(28)29)22(16-20)27-25(30)19-9-12-21(13-10-19)31-15-5-4-8-18-6-2-1-3-7-18/h1-3,6-7,9-14,16H,4-5,8,15,17H2,(H,27,30)(H,28,29)