7-[3-cyano-2-(3-methyl-3-oxidanyl-octyl)-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[3-cyano-2-(3-methyl-3-oxidanyl-octyl)-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[3-cyano-2-(3-hydroxy-3-methyl-octyl)-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[3-cyano-2-(3-hydroxy-3-methyloctyl)-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[3-cyano-2-(3-hydroxy-3-methyloctyl)-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[3-cyano-2-(3-hydroxy-3-methyl-octyl)-5-keto-cyclopentyl]enanthic acid Formula: C22H37NO4 MolecularWeight: 379.53348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(CCC1C(CC(=O)C1CCCCCCC(=O)O)C#N)O

Isomeric SMILES

CCCCCC(C)(CCC1C(CC(=O)C1CCCCCCC(=O)O)C#N)O

InChI

InChI=1S/C22H37NO4/c1-3-4-9-13-22(2,27)14-12-18-17(16-23)15-20(24)19(18)10-7-5-6-8-11-21(25)26/h17-19,27H,3-15H2,1-2H3,(H,25,26)