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

Systemtic Name: O2-(3-fluoranyl-2-methyl-butyl) O1-phenyl 4-decoxybenzene-1,2-dicarboxylate Openeye Name: O2-(3-fluoro-2-methyl-butyl) O1-phenyl 4-decoxybenzene-1,2-dicarboxylate CAS Name: 4-decoxybenzene-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-decoxybenzene-1,2-dicarboxylate Traditional Name: 4-decoxybenzene-1,2-dicarboxylic acid O2-(3-fluoro-2-methyl-butyl) ester O1-phenyl ester Formula: C29H39FO5 MolecularWeight: 486.615363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)C(=O)OCC(C)C(C)F

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)C(=O)OCC(C)C(C)F

InChI

InChI=1S/C29H39FO5/c1-4-5-6-7-8-9-10-14-19-33-25-17-18-26(29(32)35-24-15-12-11-13-16-24)27(20-25)28(31)34-21-22(2)23(3)30/h11-13,15-18,20,22-23H,4-10,14,19,21H2,1-3H3