(4-but-2-ynoxyphenyl)sulfanyl 2-(4-fluorophenyl)butanoate

Systemtic Name: (4-but-2-ynoxyphenyl)sulfanyl 2-(4-fluorophenyl)butanoate Openeye Name: (4-but-2-ynoxyphenyl)sulfanyl 2-(4-fluorophenyl)butanoate CAS Name: 2-(4-fluorophenyl)butanoic acid [(4-but-2-ynoxyphenyl)thio] ester IUPAC Name: (4-but-2-ynoxyphenyl)sulfanyl 2-(4-fluorophenyl)butanoate Traditional Name: 2-(4-fluorophenyl)butyric acid [(4-but-2-ynoxyphenyl)thio] ester Formula: C20H19FO3S MolecularWeight: 358.426463

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)F)C(=O)OSC2=CC=C(C=C2)OCC#CC

Isomeric SMILES

CCC(C1=CC=C(C=C1)F)C(=O)OSC2=CC=C(C=C2)OCC#CC

InChI

InChI=1S/C20H19FO3S/c1-3-5-14-23-17-10-12-18(13-11-17)25-24-20(22)19(4-2)15-6-8-16(21)9-7-15/h6-13,19H,4,14H2,1-2H3