2-(1,3-benzodioxol-5-yl)-2-[2,3,5,6-tetrakis(chloranyl)phenyl]ethanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-[2,3,5,6-tetrakis(chloranyl)phenyl]ethanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(2,3,5,6-tetrachlorophenyl)acetonitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(2,3,5,6-tetrachlorophenyl)acetonitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-(2,3,5,6-tetrachlorophenyl)acetonitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(2,3,5,6-tetrachlorophenyl)acetonitrile Formula: C15H7Cl4NO2 MolecularWeight: 375.03358

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C#N)C3=C(C(=CC(=C3Cl)Cl)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C#N)C3=C(C(=CC(=C3Cl)Cl)Cl)Cl

InChI

InChI=1S/C15H7Cl4NO2/c16-9-4-10(17)15(19)13(14(9)18)8(5-20)7-1-2-11-12(3-7)22-6-21-11/h1-4,8H,6H2