2-hexyl-5-(8-oxidanyl-8-oxidanylidene-octyl)cyclohex-3-ene-1-carboxylic acid; 2-methyloxirane; oxirane

Systemtic Name: 2-hexyl-5-(8-oxidanyl-8-oxidanylidene-octyl)cyclohex-3-ene-1-carboxylic acid; 2-methyloxirane; oxirane Openeye Name: 2-hexyl-5-(8-hydroxy-8-oxo-octyl)cyclohex-3-ene-1-carboxylic acid; 2-methyloxirane; oxirane CAS Name: 2-hexyl-5-(8-hydroxy-8-oxooctyl)-1-cyclohex-3-enecarboxylic acid; 2-methyloxirane; oxirane IUPAC Name: 2-hexyl-5-(8-hydroxy-8-oxooctyl)cyclohex-3-ene-1-carboxylic acid; 2-methyloxirane; oxirane Traditional Name: ethylene oxide; 2-hexyl-5-(8-hydroxy-8-keto-octyl)cyclohex-3-ene-1-carboxylic acid; propylene oxide Formula: C26H46O6 MolecularWeight: 454.63984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.CC1CO1.C1CO1

Isomeric SMILES

CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.CC1CO1.C1CO1

InChI

InChI=1S/C21H36O4.C3H6O.C2H4O/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;1-3-2-4-3;1-2-3-1/h14-15,17-19H,2-13,16H2,1H3,(H,22,23)(H,24,25);3H,2H2,1H3;1-2H2