5-(1-cyanopropyl)benzene-1,2,4-tricarbonitrile

Systemtic Name: 5-(1-cyanopropyl)benzene-1,2,4-tricarbonitrile Openeye Name: 5-(1-cyanopropyl)benzene-1,2,4-tricarbonitrile CAS Name: 5-(1-cyanopropyl)benzene-1,2,4-tricarbonitrile IUPAC Name: 5-(1-cyanopropyl)benzene-1,2,4-tricarbonitrile Traditional Name: 5-(1-cyanopropyl)benzene-1,2,4-tricarbonitrile Formula: C13H8N4 MolecularWeight: 220.22942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C1=C(C=C(C(=C1)C#N)C#N)C#N

Isomeric SMILES

CCC(C#N)C1=C(C=C(C(=C1)C#N)C#N)C#N

InChI

InChI=1S/C13H8N4/c1-2-9(5-14)13-4-11(7-16)10(6-15)3-12(13)8-17/h3-4,9H,2H2,1H3