quinolin-8-ylmethyl 6-[2,2,2-tris(fluoranyl)ethoxy]pyridine-3-carboxylate

Systemtic Name: quinolin-8-ylmethyl 6-[2,2,2-tris(fluoranyl)ethoxy]pyridine-3-carboxylate Openeye Name: 8-quinolylmethyl 6-(2,2,2-trifluoroethoxy)pyridine-3-carboxylate CAS Name: 6-(2,2,2-trifluoroethoxy)-3-pyridinecarboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 6-(2,2,2-trifluoroethoxy)pyridine-3-carboxylate Traditional Name: 6-(2,2,2-trifluoroethoxy)nicotinic acid 8-quinolylmethyl ester Formula: C18H13F3N2O3 MolecularWeight: 362.30263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)COC(=O)C3=CN=C(C=C3)OCC(F)(F)F)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)COC(=O)C3=CN=C(C=C3)OCC(F)(F)F)N=CC=C2

InChI

InChI=1S/C18H13F3N2O3/c19-18(20,21)11-26-15-7-6-13(9-23-15)17(24)25-10-14-4-1-3-12-5-2-8-22-16(12)14/h1-9H,10-11H2