[2,3-bis(fluoranyl)-4-octoxy-phenyl] 4-hexoxybenzoate

Systemtic Name: [2,3-bis(fluoranyl)-4-octoxy-phenyl] 4-hexoxybenzoate Openeye Name: (2,3-difluoro-4-octoxy-phenyl) 4-hexoxybenzoate CAS Name: 4-hexoxybenzoic acid (2,3-difluoro-4-octoxyphenyl) ester IUPAC Name: (2,3-difluoro-4-octoxyphenyl) 4-hexoxybenzoate Traditional Name: 4-hexoxybenzoic acid (2,3-difluoro-4-octoxy-phenyl) ester Formula: C27H36F2O4 MolecularWeight: 462.569146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC)F)F

InChI

InChI=1S/C27H36F2O4/c1-3-5-7-9-10-12-20-32-23-17-18-24(26(29)25(23)28)33-27(30)21-13-15-22(16-14-21)31-19-11-8-6-4-2/h13-18H,3-12,19-20H2,1-2H3