[3-fluoranyl-4-(5-pentylthiophen-2-yl)phenyl] (E)-oct-2-enoate

Systemtic Name: [3-fluoranyl-4-(5-pentylthiophen-2-yl)phenyl] (E)-oct-2-enoate Openeye Name: [3-fluoro-4-(5-pentyl-2-thienyl)phenyl] (E)-oct-2-enoate CAS Name: (E)-2-octenoic acid [3-fluoro-4-(5-pentyl-2-thiophenyl)phenyl] ester IUPAC Name: [3-fluoro-4-(5-pentylthiophen-2-yl)phenyl] (E)-oct-2-enoate Traditional Name: (E)-oct-2-enoic acid [4-(5-amyl-2-thienyl)-3-fluoro-phenyl] ester Formula: C23H29FO2S MolecularWeight: 388.538563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(=O)OC1=CC(=C(C=C1)C2=CC=C(S2)CCCCC)F

Isomeric SMILES

CCCCC/C=C/C(=O)OC1=CC(=C(C=C1)C2=CC=C(S2)CCCCC)F

InChI

InChI=1S/C23H29FO2S/c1-3-5-7-8-10-12-23(25)26-18-13-15-20(21(24)17-18)22-16-14-19(27-22)11-9-6-4-2/h10,12-17H,3-9,11H2,1-2H3/b12-10+