methyl 3-[2-[3-[2-(4-ethanoylphenoxy)ethanoylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[2-(4-ethanoylphenoxy)ethanoylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[[2-(4-acetylphenoxy)acetyl]amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[2-(4-acetylphenoxy)-1-oxoethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[[2-(4-acetylphenoxy)acetyl]amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[[2-(4-acetylphenoxy)acetyl]amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C26H21NO5 MolecularWeight: 427.44864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C26H21NO5/c1-18(28)21-11-13-24(14-12-21)32-17-25(29)27-23-8-4-6-20(16-23)10-9-19-5-3-7-22(15-19)26(30)31-2/h3-8,11-16H,17H2,1-2H3,(H,27,29)