(4-fluorophenyl)methyl (2S,4S)-2-(4-oxidanylbutoxy)-4-thiophen-3-yl-3,4-dihydro-2H-pyran-6-carboxylate

Systemtic Name: (4-fluorophenyl)methyl (2S,4S)-2-(4-oxidanylbutoxy)-4-thiophen-3-yl-3,4-dihydro-2H-pyran-6-carboxylate Openeye Name: (4-fluorophenyl)methyl (2S,4S)-2-(4-hydroxybutoxy)-4-(3-thienyl)-3,4-dihydro-2H-pyran-6-carboxylate CAS Name: (2S,4S)-2-(4-hydroxybutoxy)-4-(3-thiophenyl)-3,4-dihydro-2H-pyran-6-carboxylic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl (2S,4S)-2-(4-hydroxybutoxy)-4-thiophen-3-yl-3,4-dihydro-2H-pyran-6-carboxylate Traditional Name: (2S,4S)-2-(4-hydroxybutoxy)-4-(3-thienyl)-3,4-dihydro-2H-pyran-6-carboxylic acid (4-fluorobenzyl) ester Formula: C21H23FO5S MolecularWeight: 406.467723

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(OC1OCCCCO)C(=O)OCC2=CC=C(C=C2)F)C3=CSC=C3

Isomeric SMILES

C1[C@@H](C=C(O[C@@H]1OCCCCO)C(=O)OCC2=CC=C(C=C2)F)C3=CSC=C3

InChI

InChI=1S/C21H23FO5S/c22-18-5-3-15(4-6-18)13-26-21(24)19-11-17(16-7-10-28-14-16)12-20(27-19)25-9-2-1-8-23/h3-7,10-11,14,17,20,23H,1-2,8-9,12-13H2/t17-,20+/m1/s1