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

Systemtic Name: [5,6-bis(fluoranyl)pyridin-3-yl] 4-pentylbenzoate Openeye Name: (5,6-difluoro-3-pyridyl) 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid (5,6-difluoro-3-pyridinyl) ester IUPAC Name: (5,6-difluoropyridin-3-yl) 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid (5,6-difluoro-3-pyridyl) ester Formula: C17H17F2NO2 MolecularWeight: 305.319186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2)F)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2)F)F

InChI

InChI=1S/C17H17F2NO2/c1-2-3-4-5-12-6-8-13(9-7-12)17(21)22-14-10-15(18)16(19)20-11-14/h6-11H,2-5H2,1H3