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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)Br)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)Br)OC4=CC=C(C=C4)C#N

InChI

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