2-methylbutyl 4-[4-(4-dodecoxyphenyl)phenyl]carbonyloxy-2-fluoranyl-benzoate

Systemtic Name: 2-methylbutyl 4-[4-(4-dodecoxyphenyl)phenyl]carbonyloxy-2-fluoranyl-benzoate Openeye Name: 2-methylbutyl 4-[4-(4-dodecoxyphenyl)benzoyl]oxy-2-fluoro-benzoate CAS Name: 4-[[4-(4-dodecoxyphenyl)phenyl]-oxomethoxy]-2-fluorobenzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[4-(4-dodecoxyphenyl)benzoyl]oxy-2-fluorobenzoate Traditional Name: 2-fluoro-4-[4-(4-lauryloxyphenyl)benzoyl]oxy-benzoic acid 2-methylbutyl ester Formula: C37H47FO5 MolecularWeight: 590.764483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C(=O)OCC(C)CC)F

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C(=O)OCC(C)CC)F

InChI

InChI=1S/C37H47FO5/c1-4-6-7-8-9-10-11-12-13-14-25-41-32-21-19-30(20-22-32)29-15-17-31(18-16-29)36(39)43-33-23-24-34(35(38)26-33)37(40)42-27-28(3)5-2/h15-24,26,28H,4-14,25,27H2,1-3H3