O3-(3-fluoranyl-2-methyl-butyl) O1-phenyl 4-(4-decoxyphenyl)benzene-1,3-dicarboxylate

Systemtic Name: O3-(3-fluoranyl-2-methyl-butyl) O1-phenyl 4-(4-decoxyphenyl)benzene-1,3-dicarboxylate Openeye Name: O3-(3-fluoro-2-methyl-butyl) O1-phenyl 4-(4-decoxyphenyl)benzene-1,3-dicarboxylate CAS Name: 4-(4-decoxyphenyl)benzene-1,3-dicarboxylic acid O3-(3-fluoro-2-methylbutyl) ester O1-phenyl ester IUPAC Name: 3-O-(3-fluoro-2-methylbutyl) 1-O-phenyl 4-(4-decoxyphenyl)benzene-1,3-dicarboxylate Traditional Name: 4-(4-decoxyphenyl)benzene-1,3-dicarboxylic acid O3-(3-fluoro-2-methyl-butyl) ester O1-phenyl ester Formula: C35H43FO5 MolecularWeight: 562.711323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H43FO5/c1-4-5-6-7-8-9-10-14-23-39-30-20-17-28(18-21-30)32-22-19-29(34(37)41-31-15-12-11-13-16-31)24-33(32)35(38)40-25-26(2)27(3)36/h11-13,15-22,24,26-27H,4-10,14,23,25H2,1-3H3