2,2,2-tris(fluoranyl)ethyl 1,2,3-benzothiadiazole-7-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 1,2,3-benzothiadiazole-7-carboxylate Openeye Name: 2,2,2-trifluoroethyl 1,2,3-benzothiadiazole-7-carboxylate CAS Name: 1,2,3-benzothiadiazole-7-carboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 1,2,3-benzothiadiazole-7-carboxylate Traditional Name: 1,2,3-benzothiadiazole-7-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C9H5F3N2O2S MolecularWeight: 262.20841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N=NS2)C(=O)OCC(F)(F)F

Isomeric SMILES

C1=CC(=C2C(=C1)N=NS2)C(=O)OCC(F)(F)F

InChI

InChI=1S/C9H5F3N2O2S/c10-9(11,12)4-16-8(15)5-2-1-3-6-7(5)17-14-13-6/h1-3H,4H2