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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanenitrile Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)pentanenitrile CAS Name: 4-(1,3-dioxo-2-isoindolyl)pentanenitrile IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)pentanenitrile Traditional Name: 4-phthalimidovaleronitrile Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC#N)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(CCC#N)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C13H12N2O2/c1-9(5-4-8-14)15-12(16)10-6-2-3-7-11(10)13(15)17/h2-3,6-7,9H,4-5H2,1H3