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

Systemtic Name: [5,6-bis(fluoranyl)pyridin-3-yl] 4-butylbenzoate Openeye Name: (5,6-difluoro-3-pyridyl) 4-butylbenzoate CAS Name: 4-butylbenzoic acid (5,6-difluoro-3-pyridinyl) ester IUPAC Name: (5,6-difluoropyridin-3-yl) 4-butylbenzoate Traditional Name: 4-butylbenzoic acid (5,6-difluoro-3-pyridyl) ester Formula: C16H15F2NO2 MolecularWeight: 291.292606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2)F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(N=C2)F)F

InChI

InChI=1S/C16H15F2NO2/c1-2-3-4-11-5-7-12(8-6-11)16(20)21-13-9-14(17)15(18)19-10-13/h5-10H,2-4H2,1H3