4-[4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]benzenecarbonitrile

Systemtic Name: 4-[4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]benzenecarbonitrile Openeye Name: 4-[4-(5-bromo-1,3-dioxo-isoindolin-2-yl)phenoxy]benzonitrile CAS Name: 4-[4-(5-bromo-1,3-dioxo-2-isoindolyl)phenoxy]benzonitrile IUPAC Name: 4-[4-(5-bromo-1,3-dioxoisoindol-2-yl)phenoxy]benzonitrile Traditional Name: 4-[4-(5-bromo-1,3-diketo-isoindolin-2-yl)phenoxy]benzonitrile Formula: C21H11BrN2O3 MolecularWeight: 419.22764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H11BrN2O3/c22-14-3-10-18-19(11-14)21(26)24(20(18)25)15-4-8-17(9-5-15)27-16-6-1-13(12-23)2-7-16/h1-11H