S-(4-dodecoxyphenyl) 4-(2-fluoranyldodecoxy)benzenecarbothioate

Systemtic Name: S-(4-dodecoxyphenyl) 4-(2-fluoranyldodecoxy)benzenecarbothioate Openeye Name: S-(4-dodecoxyphenyl) 4-(2-fluorododecoxy)benzenecarbothioate CAS Name: 4-(2-fluorododecoxy)benzenecarbothioic acid S-(4-dodecoxyphenyl) ester IUPAC Name: S-(4-dodecoxyphenyl) 4-(2-fluorododecoxy)benzenecarbothioate Traditional Name: 4-(2-fluorododecoxy)thiobenzoic acid S-(4-lauryloxyphenyl) ester Formula: C37H57FO3S MolecularWeight: 600.910083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)SC(=O)C2=CC=C(C=C2)OCC(CCCCCCCCCC)F

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)SC(=O)C2=CC=C(C=C2)OCC(CCCCCCCCCC)F

InChI

InChI=1S/C37H57FO3S/c1-3-5-7-9-11-13-14-16-18-20-30-40-34-26-28-36(29-27-34)42-37(39)32-22-24-35(25-23-32)41-31-33(38)21-19-17-15-12-10-8-6-4-2/h22-29,33H,3-21,30-31H2,1-2H3