sodium (2-oxidanyl-2-oxidanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl) 10-(2-hexylcyclopropyl)decanoate

Systemtic Name: sodium (2-oxidanyl-2-oxidanylidene-1,3,2$l^{5}-dioxaphospholan-4-yl) 10-(2-hexylcyclopropyl)decanoate Openeye Name: sodium (2-hydroxy-2-oxo-1,3,2$l^{5}-dioxaphospholan-4-yl) 10-(2-hexylcyclopropyl)decanoate CAS Name: sodium 10-(2-hexylcyclopropyl)decanoic acid (2-hydroxy-2-oxo-1,3,2$l^{5}-dioxaphospholan-4-yl) ester IUPAC Name: sodium (2-hydroxy-2-oxo-1,3,2$l^{5}-dioxaphospholan-4-yl) 10-(2-hexylcyclopropyl)decanoate Traditional Name: sodium 10-(2-hexylcyclopropyl)capric acid (2-hydroxy-2-keto-1,3,2$l^{5}-dioxaphospholan-4-yl) ester Formula: C21H39NaO6P+ MolecularWeight: 441.494291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC1CCCCCCCCCC(=O)OC2COP(=O)(O2)O.[Na+]

Isomeric SMILES

CCCCCCC1CC1CCCCCCCCCC(=O)OC2COP(=O)(O2)O.[Na+]

InChI

InChI=1S/C21H39O6P.Na/c1-2-3-4-10-13-18-16-19(18)14-11-8-6-5-7-9-12-15-20(22)26-21-17-25-28(23,24)27-21;/h18-19,21H,2-17H2,1H3,(H,23,24);/q;+1