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

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-bromanyl-pentanenitrile Openeye Name: 4-bromo-5-(1,3-dioxoisoindolin-2-yl)pentanenitrile CAS Name: 4-bromo-5-(1,3-dioxo-2-isoindolyl)pentanenitrile IUPAC Name: 4-bromo-5-(1,3-dioxoisoindol-2-yl)pentanenitrile Traditional Name: 4-bromo-5-phthalimido-valeronitrile Formula: C13H11BrN2O2 MolecularWeight: 307.14264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(CCC#N)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(CCC#N)Br

InChI

InChI=1S/C13H11BrN2O2/c14-9(4-3-7-15)8-16-12(17)10-5-1-2-6-11(10)13(16)18/h1-2,5-6,9H,3-4,8H2