(4-heptoxyphenyl) 2,3-bis(fluoranyl)-4-(4-octoxyphenyl)benzoate

Systemtic Name: (4-heptoxyphenyl) 2,3-bis(fluoranyl)-4-(4-octoxyphenyl)benzoate Openeye Name: (4-heptoxyphenyl) 2,3-difluoro-4-(4-octoxyphenyl)benzoate CAS Name: 2,3-difluoro-4-(4-octoxyphenyl)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 2,3-difluoro-4-(4-octoxyphenyl)benzoate Traditional Name: 2,3-difluoro-4-(4-octoxyphenyl)benzoic acid (4-heptoxyphenyl) ester Formula: C34H42F2O4 MolecularWeight: 552.691686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCCC)F)F

InChI

InChI=1S/C34H42F2O4/c1-3-5-7-9-11-13-25-38-27-16-14-26(15-17-27)30-22-23-31(33(36)32(30)35)34(37)40-29-20-18-28(19-21-29)39-24-12-10-8-6-4-2/h14-23H,3-13,24-25H2,1-2H3