2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-carbonitrile

Systemtic Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-carbonitrile Openeye Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-carbonitrile CAS Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxin-6-carbonitrile IUPAC Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxine-6-carbonitrile Traditional Name: 2,4-bis(trichloromethyl)-4H-1,3-benzodioxin-6-carbonitrile Formula: C11H5Cl6NO2 MolecularWeight: 395.8809

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)C(OC(O2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1C#N)C(OC(O2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

InChI

InChI=1S/C11H5Cl6NO2/c12-10(13,14)8-6-3-5(4-18)1-2-7(6)19-9(20-8)11(15,16)17/h1-3,8-9H