6-chloranyl-1-(2-cyano-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-isoindole-1-carbonitrile

Systemtic Name: 6-chloranyl-1-(2-cyano-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-isoindole-1-carbonitrile Openeye Name: 2-(6-chloro-1-cyano-2-methyl-3-oxo-isoindolin-1-yl)acetyl cyanide CAS Name: 6-chloro-1-(2-cyano-2-oxoethyl)-2-methyl-3-oxo-1-isoindolecarbonitrile IUPAC Name: 2-(6-chloro-1-cyano-2-methyl-3-oxoisoindol-1-yl)acetyl cyanide Traditional Name: 6-chloro-1-(2-cyano-2-keto-ethyl)-3-keto-2-methyl-isoindoline-1-carbonitrile Formula: C13H8ClN3O2 MolecularWeight: 273.67452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1(CC(=O)C#N)C#N)C=C(C=C2)Cl

Isomeric SMILES

CN1C(=O)C2=C(C1(CC(=O)C#N)C#N)C=C(C=C2)Cl

InChI

InChI=1S/C13H8ClN3O2/c1-17-12(19)10-3-2-8(14)4-11(10)13(17,7-16)5-9(18)6-15/h2-4H,5H2,1H3