5-[3-oxidanyl-5-oxidanylidene-2-(3-oxidanyl-4-phenoxy-but-1-ynyl)cyclopentyl]pentanoic acid

Systemtic Name: 5-[3-oxidanyl-5-oxidanylidene-2-(3-oxidanyl-4-phenoxy-but-1-ynyl)cyclopentyl]pentanoic acid Openeye Name: 5-[3-hydroxy-2-(3-hydroxy-4-phenoxy-but-1-ynyl)-5-oxo-cyclopentyl]pentanoic acid CAS Name: 5-[3-hydroxy-2-(3-hydroxy-4-phenoxybut-1-ynyl)-5-oxocyclopentyl]pentanoic acid IUPAC Name: 5-[3-hydroxy-2-(3-hydroxy-4-phenoxybut-1-ynyl)-5-oxocyclopentyl]pentanoic acid Traditional Name: 5-[3-hydroxy-2-(3-hydroxy-4-phenoxy-but-1-ynyl)-5-keto-cyclopentyl]valeric acid Formula: C20H24O6 MolecularWeight: 360.40096

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1=O)CCCCC(=O)O)C#CC(COC2=CC=CC=C2)O)O

Isomeric SMILES

C1C(C(C(C1=O)CCCCC(=O)O)C#CC(COC2=CC=CC=C2)O)O

InChI

InChI=1S/C20H24O6/c21-14(13-26-15-6-2-1-3-7-15)10-11-17-16(18(22)12-19(17)23)8-4-5-9-20(24)25/h1-3,6-7,14,16-17,19,21,23H,4-5,8-9,12-13H2,(H,24,25)