[2,5,6-tris(fluoranyl)pyridin-3-yl] 4-octoxybenzoate

Systemtic Name: [2,5,6-tris(fluoranyl)pyridin-3-yl] 4-octoxybenzoate Openeye Name: (2,5,6-trifluoro-3-pyridyl) 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid (2,5,6-trifluoro-3-pyridinyl) ester IUPAC Name: (2,5,6-trifluoropyridin-3-yl) 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid (2,5,6-trifluoro-3-pyridyl) ester Formula: C20H22F3NO3 MolecularWeight: 381.38879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2F)F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2F)F)F

InChI

InChI=1S/C20H22F3NO3/c1-2-3-4-5-6-7-12-26-15-10-8-14(9-11-15)20(25)27-17-13-16(21)18(22)24-19(17)23/h8-11,13H,2-7,12H2,1H3