O2-(3-fluoranyl-2-methyl-butyl) O1-phenyl 4-dodecoxybenzene-1,2-dicarboxylate

Systemtic Name: O2-(3-fluoranyl-2-methyl-butyl) O1-phenyl 4-dodecoxybenzene-1,2-dicarboxylate Openeye Name: O2-(3-fluoro-2-methyl-butyl) O1-phenyl 4-dodecoxybenzene-1,2-dicarboxylate CAS Name: 4-dodecoxybenzene-1,2-dicarboxylic acid O2-(3-fluoro-2-methylbutyl) ester O1-phenyl ester IUPAC Name: 2-O-(3-fluoro-2-methylbutyl) 1-O-phenyl 4-dodecoxybenzene-1,2-dicarboxylate Traditional Name: 4-lauryloxybenzene-1,2-dicarboxylic acid O2-(3-fluoro-2-methyl-butyl) ester O1-phenyl ester Formula: C31H43FO5 MolecularWeight: 514.668523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)C(=O)OCC(C)C(C)F

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)C(=O)OCC(C)C(C)F

InChI

InChI=1S/C31H43FO5/c1-4-5-6-7-8-9-10-11-12-16-21-35-27-19-20-28(31(34)37-26-17-14-13-15-18-26)29(22-27)30(33)36-23-24(2)25(3)32/h13-15,17-20,22,24-25H,4-12,16,21,23H2,1-3H3