5-(3,4-dimethylphenoxy)-2-quinolin-5-yl-isoindole-1,3-dione

Systemtic Name: 5-(3,4-dimethylphenoxy)-2-quinolin-5-yl-isoindole-1,3-dione Openeye Name: 5-(3,4-dimethylphenoxy)-2-(5-quinolyl)isoindoline-1,3-dione CAS Name: 5-(3,4-dimethylphenoxy)-2-(5-quinolinyl)isoindole-1,3-dione IUPAC Name: 5-(3,4-dimethylphenoxy)-2-quinolin-5-ylisoindole-1,3-dione Traditional Name: 5-(3,4-dimethylphenoxy)-2-(5-quinolyl)isoindoline-1,3-quinone Formula: C25H18N2O3 MolecularWeight: 394.42202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC5=C4C=CC=N5)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC5=C4C=CC=N5)C

InChI

InChI=1S/C25H18N2O3/c1-15-8-9-17(13-16(15)2)30-18-10-11-19-21(14-18)25(29)27(24(19)28)23-7-3-6-22-20(23)5-4-12-26-22/h3-14H,1-2H3