[2-fluoranyl-6-(4-octoxyphenyl)pyridin-3-yl] 5-butylthiophene-2-carboxylate

Systemtic Name: [2-fluoranyl-6-(4-octoxyphenyl)pyridin-3-yl] 5-butylthiophene-2-carboxylate Openeye Name: [2-fluoro-6-(4-octoxyphenyl)-3-pyridyl] 5-butylthiophene-2-carboxylate CAS Name: 5-butyl-2-thiophenecarboxylic acid [2-fluoro-6-(4-octoxyphenyl)-3-pyridinyl] ester IUPAC Name: [2-fluoro-6-(4-octoxyphenyl)pyridin-3-yl] 5-butylthiophene-2-carboxylate Traditional Name: 5-butylthiophene-2-carboxylic acid [2-fluoro-6-(4-octoxyphenyl)-3-pyridyl] ester Formula: C28H34FNO3S MolecularWeight: 483.637863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC(=C(C=C2)OC(=O)C3=CC=C(S3)CCCC)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC(=C(C=C2)OC(=O)C3=CC=C(S3)CCCC)F

InChI

InChI=1S/C28H34FNO3S/c1-3-5-7-8-9-10-20-32-22-14-12-21(13-15-22)24-17-18-25(27(29)30-24)33-28(31)26-19-16-23(34-26)11-6-4-2/h12-19H,3-11,20H2,1-2H3