4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 4-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-1,2,4-triazole-3-carbonitrile CAS Name: 4-[2-(1,3-dioxo-2-isoindolyl)ethyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 4-[2-(1,3-dioxoisoindol-2-yl)ethyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 4-(2-phthalimidoethyl)-1,2,4-triazole-3-carbonitrile Formula: C13H9N5O2 MolecularWeight: 267.24286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCN3C=NN=C3C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCN3C=NN=C3C#N

InChI

InChI=1S/C13H9N5O2/c14-7-11-16-15-8-17(11)5-6-18-12(19)9-3-1-2-4-10(9)13(18)20/h1-4,8H,5-6H2