1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-3-nitro-pyrazole

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-3-nitro-pyrazole Openeye Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-3-nitro-pyrazole CAS Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-3-nitropyrazole IUPAC Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-3-nitropyrazole Traditional Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-mesyl-3-nitro-pyrazole Formula: C11H6Cl2F3N3O4S MolecularWeight: 404.14925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN(N=C1[N+](=O)[O-])C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

Isomeric SMILES

CS(=O)(=O)C1=CN(N=C1[N+](=O)[O-])C2=C(C=C(C=C2Cl)C(F)(F)F)Cl

InChI

InChI=1S/C11H6Cl2F3N3O4S/c1-24(22,23)8-4-18(17-10(8)19(20)21)9-6(12)2-5(3-7(9)13)11(14,15)16/h2-4H,1H3