[4-(2-fluoranyl-4-undecyl-phenyl)phenyl] 5-pentylthiophene-2-carboxylate

Systemtic Name: [4-(2-fluoranyl-4-undecyl-phenyl)phenyl] 5-pentylthiophene-2-carboxylate Openeye Name: [4-(2-fluoro-4-undecyl-phenyl)phenyl] 5-pentylthiophene-2-carboxylate CAS Name: 5-pentyl-2-thiophenecarboxylic acid [4-(2-fluoro-4-undecylphenyl)phenyl] ester IUPAC Name: [4-(2-fluoro-4-undecylphenyl)phenyl] 5-pentylthiophene-2-carboxylate Traditional Name: 5-amylthiophene-2-carboxylic acid [4-(2-fluoro-4-undecyl-phenyl)phenyl] ester Formula: C33H43FO2S MolecularWeight: 522.756723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(S3)CCCCC)F

Isomeric SMILES

CCCCCCCCCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(S3)CCCCC)F

InChI

InChI=1S/C33H43FO2S/c1-3-5-7-8-9-10-11-12-14-15-26-17-23-30(31(34)25-26)27-18-20-28(21-19-27)36-33(35)32-24-22-29(37-32)16-13-6-4-2/h17-25H,3-16H2,1-2H3