potassium 2-hexyl-5-(8-oxidanyl-8-oxidanylidene-octyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: potassium 2-hexyl-5-(8-oxidanyl-8-oxidanylidene-octyl)cyclohex-3-ene-1-carboxylate Openeye Name: potassium 2-hexyl-5-(8-hydroxy-8-oxo-octyl)cyclohex-3-ene-1-carboxylate CAS Name: potassium 2-hexyl-5-(8-hydroxy-8-oxooctyl)-1-cyclohex-3-enecarboxylate IUPAC Name: potassium 2-hexyl-5-(8-hydroxy-8-oxooctyl)cyclohex-3-ene-1-carboxylate Traditional Name: potassium 2-hexyl-5-(8-hydroxy-8-keto-octyl)cyclohex-3-ene-1-carboxylate Formula: C21H35KO4 MolecularWeight: 390.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C=CC(CC1C(=O)[O-])CCCCCCCC(=O)O.[K+]

Isomeric SMILES

CCCCCCC1C=CC(CC1C(=O)[O-])CCCCCCCC(=O)O.[K+]

InChI

InChI=1S/C21H36O4.K/c1-2-3-4-9-12-18-15-14-17(16-19(18)21(24)25)11-8-6-5-7-10-13-20(22)23;/h14-15,17-19H,2-13,16H2,1H3,(H,22,23)(H,24,25);/q;+1/p-1