(4-octoxyphenyl) 2,3-bis(fluoranyl)-4-(3-fluoranyl-4-heptoxy-phenyl)benzoate

Systemtic Name: (4-octoxyphenyl) 2,3-bis(fluoranyl)-4-(3-fluoranyl-4-heptoxy-phenyl)benzoate Openeye Name: (4-octoxyphenyl) 2,3-difluoro-4-(3-fluoro-4-heptoxy-phenyl)benzoate CAS Name: 2,3-difluoro-4-(3-fluoro-4-heptoxyphenyl)benzoic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 2,3-difluoro-4-(3-fluoro-4-heptoxyphenyl)benzoate Traditional Name: 2,3-difluoro-4-(3-fluoro-4-heptoxy-phenyl)benzoic acid (4-octoxyphenyl) ester Formula: C34H41F3O4 MolecularWeight: 570.68215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)C3=CC(=C(C=C3)OCCCCCCC)F)F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)C3=CC(=C(C=C3)OCCCCCCC)F)F)F

InChI

InChI=1S/C34H41F3O4/c1-3-5-7-9-11-12-22-39-26-15-17-27(18-16-26)41-34(38)29-20-19-28(32(36)33(29)37)25-14-21-31(30(35)24-25)40-23-13-10-8-6-4-2/h14-21,24H,3-13,22-23H2,1-2H3