3-[2,2,2-tris(chloranyl)-1-oxidanyl-ethyl]benzenecarbonitrile

Systemtic Name: 3-[2,2,2-tris(chloranyl)-1-oxidanyl-ethyl]benzenecarbonitrile Openeye Name: 3-(2,2,2-trichloro-1-hydroxy-ethyl)benzonitrile CAS Name: 3-(2,2,2-trichloro-1-hydroxyethyl)benzonitrile IUPAC Name: 3-(2,2,2-trichloro-1-hydroxyethyl)benzonitrile Traditional Name: 3-(2,2,2-trichloro-1-hydroxy-ethyl)benzonitrile Formula: C9H6Cl3NO MolecularWeight: 250.50904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6Cl3NO/c10-9(11,12)8(14)7-3-1-2-6(4-7)5-13/h1-4,8,14H