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

Systemtic Name: ethane; 2-[3,4,5-tris(bromanyl)pyrazol-1-yl]propanenitrile Openeye Name: ethane; 2-(3,4,5-tribromopyrazol-1-yl)propanenitrile CAS Name: ethane; 2-(3,4,5-tribromo-1-pyrazolyl)propanenitrile IUPAC Name: ethane; 2-(3,4,5-tribromopyrazol-1-yl)propanenitrile Traditional Name: ethane; 2-(3,4,5-tribromopyrazol-1-yl)propionitrile Formula: C8H10Br3N3 MolecularWeight: 387.8971

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H4Br3N3.C2H6/c1-3(2-10)12-6(9)4(7)5(8)11-12;1-2/h3H,1H3;1-2H3