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

Systemtic Name: [2,3-bis(fluoranyl)-4-nonyl-phenyl] 2-fluoranyl-4-pentoxy-benzoate Openeye Name: (2,3-difluoro-4-nonyl-phenyl) 2-fluoro-4-pentoxy-benzoate CAS Name: 2-fluoro-4-pentoxybenzoic acid (2,3-difluoro-4-nonylphenyl) ester IUPAC Name: (2,3-difluoro-4-nonylphenyl) 2-fluoro-4-pentoxybenzoate Traditional Name: 4-amoxy-2-fluoro-benzoic acid (2,3-difluoro-4-nonyl-phenyl) ester Formula: C27H35F3O3 MolecularWeight: 464.56021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C=C1)OC(=O)C2=C(C=C(C=C2)OCCCCC)F)F)F

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C=C1)OC(=O)C2=C(C=C(C=C2)OCCCCC)F)F)F

InChI

InChI=1S/C27H35F3O3/c1-3-5-7-8-9-10-11-13-20-14-17-24(26(30)25(20)29)33-27(31)22-16-15-21(19-23(22)28)32-18-12-6-4-2/h14-17,19H,3-13,18H2,1-2H3