2-[2,3-bis(3-chloranyl-4-oxidanyl-phenyl)phenyl]-2-oxidanyl-ethanenitrile

Systemtic Name: 2-[2,3-bis(3-chloranyl-4-oxidanyl-phenyl)phenyl]-2-oxidanyl-ethanenitrile Openeye Name: 2-[2,3-bis(3-chloro-4-hydroxy-phenyl)phenyl]-2-hydroxy-acetonitrile CAS Name: 2-[2,3-bis(3-chloro-4-hydroxyphenyl)phenyl]-2-hydroxyacetonitrile IUPAC Name: 2-[2,3-bis(3-chloro-4-hydroxyphenyl)phenyl]-2-hydroxyacetonitrile Traditional Name: 2-[2,3-bis(3-chloro-4-hydroxy-phenyl)phenyl]-2-hydroxy-acetonitrile Formula: C20H13Cl2NO3 MolecularWeight: 386.22812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C(C#N)O)C2=CC(=C(C=C2)O)Cl)C3=CC(=C(C=C3)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)C(C#N)O)C2=CC(=C(C=C2)O)Cl)C3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C20H13Cl2NO3/c21-15-8-11(4-6-17(15)24)13-2-1-3-14(19(26)10-23)20(13)12-5-7-18(25)16(22)9-12/h1-9,19,24-26H