2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-phenyl-propanenitrile

Systemtic Name: 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-phenyl-propanenitrile Openeye Name: 2-benzyl-3-(1,3-dioxoisoindolin-2-yl)propanenitrile CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methyl]-3-phenylpropanenitrile IUPAC Name: 2-benzyl-3-(1,3-dioxoisoindol-2-yl)propanenitrile Traditional Name: 2-benzyl-3-phthalimido-propionitrile Formula: C18H14N2O2 MolecularWeight: 290.31596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN2C(=O)C3=CC=CC=C3C2=O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CC(CN2C(=O)C3=CC=CC=C3C2=O)C#N

InChI

InChI=1S/C18H14N2O2/c19-11-14(10-13-6-2-1-3-7-13)12-20-17(21)15-8-4-5-9-16(15)18(20)22/h1-9,14H,10,12H2