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

Systemtic Name: [2,5,6-tris(fluoranyl)pyridin-3-yl] 4-pentylbenzoate Openeye Name: (2,5,6-trifluoro-3-pyridyl) 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid (2,5,6-trifluoro-3-pyridinyl) ester IUPAC Name: (2,5,6-trifluoropyridin-3-yl) 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid (2,5,6-trifluoro-3-pyridyl) ester Formula: C17H16F3NO2 MolecularWeight: 323.30965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2F)F)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2F)F)F

InChI

InChI=1S/C17H16F3NO2/c1-2-3-4-5-11-6-8-12(9-7-11)17(22)23-14-10-13(18)15(19)21-16(14)20/h6-10H,2-5H2,1H3