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

Systemtic Name: 5-(2-oxidanylideneazetidin-1-yl)-1-[2,3,4-tris(chloranyl)phenyl]pyrazole-4-carbonitrile Openeye Name: 5-(2-oxoazetidin-1-yl)-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile CAS Name: 5-(2-oxo-1-azetidinyl)-1-(2,3,4-trichlorophenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(2-oxoazetidin-1-yl)-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile Traditional Name: 5-(2-ketoazetidin-1-yl)-1-(2,3,4-trichlorophenyl)pyrazole-4-carbonitrile Formula: C13H7Cl3N4O MolecularWeight: 341.57988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1=O)C2=C(C=NN2C3=C(C(=C(C=C3)Cl)Cl)Cl)C#N

Isomeric SMILES

C1CN(C1=O)C2=C(C=NN2C3=C(C(=C(C=C3)Cl)Cl)Cl)C#N

InChI

InChI=1S/C13H7Cl3N4O/c14-8-1-2-9(12(16)11(8)15)20-13(7(5-17)6-18-20)19-4-3-10(19)21/h1-2,6H,3-4H2