methane; 2-[3,4,5-tris(bromanyl)pyrazol-1-yl]ethanenitrile

Systemtic Name: methane; 2-[3,4,5-tris(bromanyl)pyrazol-1-yl]ethanenitrile Openeye Name: methane; 2-(3,4,5-tribromopyrazol-1-yl)acetonitrile CAS Name: methane; 2-(3,4,5-tribromo-1-pyrazolyl)acetonitrile IUPAC Name: methane; 2-(3,4,5-tribromopyrazol-1-yl)acetonitrile Traditional Name: methane; 2-(3,4,5-tribromopyrazol-1-yl)acetonitrile Formula: C6H6Br3N3 MolecularWeight: 359.84394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C.C(C#N)N1C(=C(C(=N1)Br)Br)Br

Isomeric SMILES

C.C(C#N)N1C(=C(C(=N1)Br)Br)Br

InChI

InChI=1S/C5H2Br3N3.CH4/c6-3-4(7)10-11(2-1-9)5(3)8;/h2H2;1H4