(phenylmethyl) 7-[3-(oxan-2-yloxy)-5-oxidanylidene-cyclopenten-1-yl]sulfanylheptanoate

Systemtic Name: (phenylmethyl) 7-[3-(oxan-2-yloxy)-5-oxidanylidene-cyclopenten-1-yl]sulfanylheptanoate Openeye Name: benzyl 7-(5-oxo-3-tetrahydropyran-2-yloxy-cyclopenten-1-yl)sulfanylheptanoate CAS Name: 7-[[3-(2-oxanyloxy)-5-oxo-1-cyclopentenyl]thio]heptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 7-[3-(oxan-2-yloxy)-5-oxocyclopenten-1-yl]sulfanylheptanoate Traditional Name: 7-[(5-keto-3-tetrahydropyran-2-yloxy-cyclopenten-1-yl)thio]enanthic acid benzyl ester Formula: C24H32O5S MolecularWeight: 432.57288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC2CC(=O)C(=C2)SCCCCCCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCOC(C1)OC2CC(=O)C(=C2)SCCCCCCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H32O5S/c25-21-16-20(29-24-13-7-8-14-27-24)17-22(21)30-15-9-2-1-6-12-23(26)28-18-19-10-4-3-5-11-19/h3-5,10-11,17,20,24H,1-2,6-9,12-16,18H2