5-(bromomethyl)-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-4-carbonitrile

Systemtic Name: 5-(bromomethyl)-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-4-carbonitrile Openeye Name: 5-(bromomethyl)-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile CAS Name: 5-(bromomethyl)-1-(2,4,6-trichlorophenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(bromomethyl)-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile Traditional Name: 5-(bromomethyl)-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile Formula: C11H5BrCl3N3 MolecularWeight: 365.4405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C(=C(C=N2)C#N)CBr)Cl)Cl

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C(=C(C=N2)C#N)CBr)Cl)Cl

InChI

InChI=1S/C11H5BrCl3N3/c12-3-10-6(4-16)5-17-18(10)11-8(14)1-7(13)2-9(11)15/h1-2,5H,3H2