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

Systemtic Name: [3-fluoranyl-4-(5-pentylthiophen-2-yl)phenyl] (E)-but-2-enoate Openeye Name: [3-fluoro-4-(5-pentyl-2-thienyl)phenyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [3-fluoro-4-(5-pentyl-2-thiophenyl)phenyl] ester IUPAC Name: [3-fluoro-4-(5-pentylthiophen-2-yl)phenyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [4-(5-amyl-2-thienyl)-3-fluoro-phenyl] ester Formula: C19H21FO2S MolecularWeight: 332.432243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(S1)C2=C(C=C(C=C2)OC(=O)C=CC)F

Isomeric SMILES

CCCCCC1=CC=C(S1)C2=C(C=C(C=C2)OC(=O)/C=C/C)F

InChI

InChI=1S/C19H21FO2S/c1-3-5-6-8-15-10-12-18(23-15)16-11-9-14(13-17(16)20)22-19(21)7-4-2/h4,7,9-13H,3,5-6,8H2,1-2H3/b7-4+