[2,3-bis(fluoranyl)-4-pentyl-phenyl] 2-fluoranyl-4-heptoxy-benzoate

Systemtic Name: [2,3-bis(fluoranyl)-4-pentyl-phenyl] 2-fluoranyl-4-heptoxy-benzoate Openeye Name: (2,3-difluoro-4-pentyl-phenyl) 2-fluoro-4-heptoxy-benzoate CAS Name: 2-fluoro-4-heptoxybenzoic acid (2,3-difluoro-4-pentylphenyl) ester IUPAC Name: (2,3-difluoro-4-pentylphenyl) 2-fluoro-4-heptoxybenzoate Traditional Name: 2-fluoro-4-heptoxy-benzoic acid (4-amyl-2,3-difluoro-phenyl) ester Formula: C25H31F3O3 MolecularWeight: 436.50705

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=C(C(=C(C=C2)CCCCC)F)F)F

Isomeric SMILES

CCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=C(C(=C(C=C2)CCCCC)F)F)F

InChI

InChI=1S/C25H31F3O3/c1-3-5-7-8-10-16-30-19-13-14-20(21(26)17-19)25(29)31-22-15-12-18(11-9-6-4-2)23(27)24(22)28/h12-15,17H,3-11,16H2,1-2H3