[2,3-bis(fluoranyl)-4-heptyl-phenyl] 2-fluoranyl-4-pentoxy-benzoate

Systemtic Name: [2,3-bis(fluoranyl)-4-heptyl-phenyl] 2-fluoranyl-4-pentoxy-benzoate Openeye Name: (2,3-difluoro-4-heptyl-phenyl) 2-fluoro-4-pentoxy-benzoate CAS Name: 2-fluoro-4-pentoxybenzoic acid (2,3-difluoro-4-heptylphenyl) ester IUPAC Name: (2,3-difluoro-4-heptylphenyl) 2-fluoro-4-pentoxybenzoate Traditional Name: 4-amoxy-2-fluoro-benzoic acid (2,3-difluoro-4-heptyl-phenyl) ester Formula: C25H31F3O3 MolecularWeight: 436.50705

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C=C1)OC(=O)C2=C(C=C(C=C2)OCCCCC)F)F)F

Isomeric SMILES

CCCCCCCC1=C(C(=C(C=C1)OC(=O)C2=C(C=C(C=C2)OCCCCC)F)F)F

InChI

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