2-[4-[[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]phenyl]carbonylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]phenyl]carbonylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[[3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]benzoyl]amino]phenyl]acetic acid CAS Name: 2-[4-[[[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]-oxomethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]benzoyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]benzoyl]amino]phenyl]acetic acid Formula: C27H27NO6 MolecularWeight: 461.50638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C27H27NO6/c1-3-5-23-24(13-12-22(17(2)29)26(23)32)34-16-19-6-4-7-20(14-19)27(33)28-21-10-8-18(9-11-21)15-25(30)31/h4,6-14,32H,3,5,15-16H2,1-2H3,(H,28,33)(H,30,31)