methyl 3-[2-[3-[2-(2-oxidanylidenequinoxalin-1-yl)ethanoylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[2-(2-oxidanylidenequinoxalin-1-yl)ethanoylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[1-oxo-2-(2-oxo-1-quinoxalinyl)ethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[[2-(2-ketoquinoxalin-1-yl)acetyl]amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C26H19N3O4 MolecularWeight: 437.44676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C#CC2=CC(=CC=C2)NC(=O)CN3C4=CC=CC=C4N=CC3=O

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C#CC2=CC(=CC=C2)NC(=O)CN3C4=CC=CC=C4N=CC3=O

InChI

InChI=1S/C26H19N3O4/c1-33-26(32)20-8-4-6-18(14-20)12-13-19-7-5-9-21(15-19)28-24(30)17-29-23-11-3-2-10-22(23)27-16-25(29)31/h2-11,14-16H,17H2,1H3,(H,28,30)