methyl 7-[(1S,2S,3R)-3-oxidanyl-5-oxidanylidene-2-[(3S)-3-oxidanyloct-1-ynyl]cyclopentyl]heptanoate

Systemtic Name: methyl 7-[(1S,2S,3R)-3-oxidanyl-5-oxidanylidene-2-[(3S)-3-oxidanyloct-1-ynyl]cyclopentyl]heptanoate Openeye Name: methyl 7-[(1S,2S,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-ynyl]-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[(1S,2S,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-ynyl]-5-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[(1S,2S,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-ynyl]-5-oxocyclopentyl]heptanoate Traditional Name: 7-[(1S,2S,3R)-3-hydroxy-2-[(3S)-3-hydroxyoct-1-ynyl]-5-keto-cyclopentyl]enanthic acid methyl ester Formula: C21H34O5 MolecularWeight: 366.49166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#CC1C(CC(=O)C1CCCCCCC(=O)OC)O)O

Isomeric SMILES

CCCCC[C@@H](C#C[C@H]1[C@@H](CC(=O)[C@H]1CCCCCCC(=O)OC)O)O

InChI

InChI=1S/C21H34O5/c1-3-4-7-10-16(22)13-14-18-17(19(23)15-20(18)24)11-8-5-6-9-12-21(25)26-2/h16-18,20,22,24H,3-12,15H2,1-2H3/t16-,17-,18+,20+/m0/s1