ethyl 2-[3-oxidanyl-5-oxidanylidene-2-(2-oxidanyl-3-phenoxy-propoxy)cyclopentyl]-4-sulfanylidene-butanoate

Systemtic Name: ethyl 2-[3-oxidanyl-5-oxidanylidene-2-(2-oxidanyl-3-phenoxy-propoxy)cyclopentyl]-4-sulfanylidene-butanoate Openeye Name: ethyl 2-[3-hydroxy-2-(2-hydroxy-3-phenoxy-propoxy)-5-oxo-cyclopentyl]-4-thioxo-butanoate CAS Name: 2-[3-hydroxy-2-(2-hydroxy-3-phenoxypropoxy)-5-oxocyclopentyl]-4-sulfanylidenebutanoic acid ethyl ester IUPAC Name: ethyl 2-[3-hydroxy-2-(2-hydroxy-3-phenoxypropoxy)-5-oxocyclopentyl]-4-sulfanylidenebutanoate Traditional Name: 2-[3-hydroxy-2-(2-hydroxy-3-phenoxy-propoxy)-5-keto-cyclopentyl]-4-thioxo-butyric acid ethyl ester Formula: C20H26O7S MolecularWeight: 410.48124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=S)C1C(C(CC1=O)O)OCC(COC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C(CC=S)C1C(C(CC1=O)O)OCC(COC2=CC=CC=C2)O

InChI

InChI=1S/C20H26O7S/c1-2-25-20(24)15(8-9-28)18-16(22)10-17(23)19(18)27-12-13(21)11-26-14-6-4-3-5-7-14/h3-7,9,13,15,17-19,21,23H,2,8,10-12H2,1H3