7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-nonanoic acid

Systemtic Name: 7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-nonanoic acid Openeye Name: 2-hydroxy-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]nonanoic acid CAS Name: 2-hydroxy-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]nonanoic acid IUPAC Name: 2-hydroxy-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]nonanoic acid Traditional Name: 2-hydroxy-7-[(1R,5R)-2-keto-5-[(E)-oct-1-enyl]cyclopentyl]pelargonic acid Formula: C22H38O4 MolecularWeight: 366.53472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CCC(=O)C1C(CC)CCCCC(C(=O)O)O

Isomeric SMILES

CCCCCC/C=C/[C@H]1CCC(=O)[C@@H]1C(CC)CCCCC(C(=O)O)O

InChI

InChI=1S/C22H38O4/c1-3-5-6-7-8-9-13-18-15-16-19(23)21(18)17(4-2)12-10-11-14-20(24)22(25)26/h9,13,17-18,20-21,24H,3-8,10-12,14-16H2,1-2H3,(H,25,26)/b13-9+/t17?,18-,20?,21+/m0/s1