2-[2,2,2-tris(chloranyl)-1-pyridin-3-yl-ethyl]benzoic acid

Systemtic Name: 2-[2,2,2-tris(chloranyl)-1-pyridin-3-yl-ethyl]benzoic acid Openeye Name: 2-[2,2,2-trichloro-1-(3-pyridyl)ethyl]benzoic acid CAS Name: 2-[2,2,2-trichloro-1-(3-pyridinyl)ethyl]benzoic acid IUPAC Name: 2-(2,2,2-trichloro-1-pyridin-3-ylethyl)benzoic acid Traditional Name: 2-[2,2,2-trichloro-1-(3-pyridyl)ethyl]benzoic acid Formula: C14H10Cl3NO2 MolecularWeight: 330.5937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C2=CN=CC=C2)C(Cl)(Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(C2=CN=CC=C2)C(Cl)(Cl)Cl)C(=O)O

InChI

InChI=1S/C14H10Cl3NO2/c15-14(16,17)12(9-4-3-7-18-8-9)10-5-1-2-6-11(10)13(19)20/h1-8,12H,(H,19,20)