(2-fluoranyl-4-heptoxy-phenyl) 4-(3-fluoranyl-4-heptoxy-phenyl)benzoate

Systemtic Name: (2-fluoranyl-4-heptoxy-phenyl) 4-(3-fluoranyl-4-heptoxy-phenyl)benzoate Openeye Name: (2-fluoro-4-heptoxy-phenyl) 4-(3-fluoro-4-heptoxy-phenyl)benzoate CAS Name: 4-(3-fluoro-4-heptoxyphenyl)benzoic acid (2-fluoro-4-heptoxyphenyl) ester IUPAC Name: (2-fluoro-4-heptoxyphenyl) 4-(3-fluoro-4-heptoxyphenyl)benzoate Traditional Name: 4-(3-fluoro-4-heptoxy-phenyl)benzoic acid (2-fluoro-4-heptoxy-phenyl) ester Formula: C33H40F2O4 MolecularWeight: 538.665106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H40F2O4/c1-3-5-7-9-11-21-37-28-18-20-32(30(35)24-28)39-33(36)26-15-13-25(14-16-26)27-17-19-31(29(34)23-27)38-22-12-10-8-6-4-2/h13-20,23-24H,3-12,21-22H2,1-2H3