[2,2,2-tris(bromanyl)-1-pyridin-3-yl-ethyl] 2-chloranylbenzoate

Systemtic Name: [2,2,2-tris(bromanyl)-1-pyridin-3-yl-ethyl] 2-chloranylbenzoate Openeye Name: [2,2,2-tribromo-1-(3-pyridyl)ethyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [2,2,2-tribromo-1-(3-pyridinyl)ethyl] ester IUPAC Name: (2,2,2-tribromo-1-pyridin-3-ylethyl) 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [2,2,2-tribromo-1-(3-pyridyl)ethyl] ester Formula: C14H9Br3ClNO2 MolecularWeight: 498.39176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9Br3ClNO2/c15-14(16,17)12(9-4-3-7-19-8-9)21-13(20)10-5-1-2-6-11(10)18/h1-8,12H