2-[1,3-bis(oxidanylidene)-2-phenyl-7aH-isoindol-3a-yl]ethanenitrile

Systemtic Name: 2-[1,3-bis(oxidanylidene)-2-phenyl-7aH-isoindol-3a-yl]ethanenitrile Openeye Name: 2-(1,3-dioxo-2-phenyl-7aH-isoindol-3a-yl)acetonitrile CAS Name: 2-(1,3-dioxo-2-phenyl-7aH-isoindol-3a-yl)acetonitrile IUPAC Name: 2-(1,3-dioxo-2-phenyl-7aH-isoindol-3a-yl)acetonitrile Traditional Name: 2-(1,3-diketo-2-phenyl-7aH-isoindol-3a-yl)acetonitrile Formula: C16H12N2O2 MolecularWeight: 264.27868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3C=CC=CC3(C2=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3C=CC=CC3(C2=O)CC#N

InChI

InChI=1S/C16H12N2O2/c17-11-10-16-9-5-4-8-13(16)14(19)18(15(16)20)12-6-2-1-3-7-12/h1-9,13H,10H2