5-azanyl-1-[2,3,4-tris(chloranyl)phenyl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[2,3,4-tris(chloranyl)phenyl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2,3,4-trichlorophenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile Formula: C10H5Cl3N4 MolecularWeight: 287.5325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1N2C(=C(C=N2)C#N)N)Cl)Cl)Cl

Isomeric SMILES

C1=CC(=C(C(=C1N2C(=C(C=N2)C#N)N)Cl)Cl)Cl

InChI

InChI=1S/C10H5Cl3N4/c11-6-1-2-7(9(13)8(6)12)17-10(15)5(3-14)4-16-17/h1-2,4H,15H2