(4-heptoxyphenyl) 2,3-bis(fluoranyl)-4-(3-fluoranyl-4-hexyl-phenyl)benzoate

Systemtic Name: (4-heptoxyphenyl) 2,3-bis(fluoranyl)-4-(3-fluoranyl-4-hexyl-phenyl)benzoate Openeye Name: (4-heptoxyphenyl) 2,3-difluoro-4-(3-fluoro-4-hexyl-phenyl)benzoate CAS Name: 2,3-difluoro-4-(3-fluoro-4-hexylphenyl)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 2,3-difluoro-4-(3-fluoro-4-hexylphenyl)benzoate Traditional Name: 2,3-difluoro-4-(3-fluoro-4-hexyl-phenyl)benzoic acid (4-heptoxyphenyl) ester Formula: C32H37F3O3 MolecularWeight: 526.62959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)C3=CC(=C(C=C3)CCCCCC)F)F)F

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)C3=CC(=C(C=C3)CCCCCC)F)F)F

InChI

InChI=1S/C32H37F3O3/c1-3-5-7-9-11-21-37-25-15-17-26(18-16-25)38-32(36)28-20-19-27(30(34)31(28)35)24-14-13-23(29(33)22-24)12-10-8-6-4-2/h13-20,22H,3-12,21H2,1-2H3