sodium 7-[(1R,5R)-2-oxidanylidene-5-[(E,3S)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoate

Systemtic Name: sodium 7-[(1R,5R)-2-oxidanylidene-5-[(E,3S)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoate Openeye Name: sodium 7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]heptanoate CAS Name: sodium 7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoate IUPAC Name: sodium 7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoate Traditional Name: sodium 7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-keto-cyclopentyl]enanthate Formula: C20H33NaO4 MolecularWeight: 360.46339

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)C1CCCCCCC(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCC[C@@H](/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C20H34O4.Na/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24;/h12,14,16-18,21H,2-11,13,15H2,1H3,(H,23,24);/q;+1/p-1/b14-12+;/t16-,17-,18+;/m0./s1