[2,3-bis(fluoranyl)-4-nonoxy-phenyl] 4-(4-decoxy-3-fluoranyl-phenyl)benzoate

Systemtic Name: [2,3-bis(fluoranyl)-4-nonoxy-phenyl] 4-(4-decoxy-3-fluoranyl-phenyl)benzoate Openeye Name: (2,3-difluoro-4-nonoxy-phenyl) 4-(4-decoxy-3-fluoro-phenyl)benzoate CAS Name: 4-(4-decoxy-3-fluorophenyl)benzoic acid (2,3-difluoro-4-nonoxyphenyl) ester IUPAC Name: (2,3-difluoro-4-nonoxyphenyl) 4-(4-decoxy-3-fluorophenyl)benzoate Traditional Name: 4-(4-decoxy-3-fluoro-phenyl)benzoic acid (2,3-difluoro-4-nonoxy-phenyl) ester Formula: C38H49F3O4 MolecularWeight: 626.78847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)OCCCCCCCCC)F)F)F

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)OCCCCCCCCC)F)F)F

InChI

InChI=1S/C38H49F3O4/c1-3-5-7-9-11-13-15-16-26-43-33-23-22-31(28-32(33)39)29-18-20-30(21-19-29)38(42)45-35-25-24-34(36(40)37(35)41)44-27-17-14-12-10-8-6-4-2/h18-25,28H,3-17,26-27H2,1-2H3