(2,3-dimethylquinoxalin-6-yl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: (2,3-dimethylquinoxalin-6-yl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: (2,3-dimethylquinoxalin-6-yl) 4-(1,3-dioxoisoindolin-2-yl)benzoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)benzoic acid (2,3-dimethyl-6-quinoxalinyl) ester IUPAC Name: (2,3-dimethylquinoxalin-6-yl) 4-(1,3-dioxoisoindol-2-yl)benzoate Traditional Name: 4-phthalimidobenzoic acid (2,3-dimethylquinoxalin-6-yl) ester Formula: C25H17N3O4 MolecularWeight: 423.42018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5C4=O)N=C1C

InChI

InChI=1S/C25H17N3O4/c1-14-15(2)27-22-13-18(11-12-21(22)26-14)32-25(31)16-7-9-17(10-8-16)28-23(29)19-5-3-4-6-20(19)24(28)30/h3-13H,1-2H3