dipotassium 5-[3-(4-oxidanidyl-4-oxidanylidene-butyl)-2-tetradec-1-ynyl-oxiran-2-yl]pentanoate

Systemtic Name: dipotassium 5-[3-(4-oxidanidyl-4-oxidanylidene-butyl)-2-tetradec-1-ynyl-oxiran-2-yl]pentanoate Openeye Name: dipotassium 5-[3-(4-oxido-4-oxo-butyl)-2-tetradec-1-ynyl-oxiran-2-yl]pentanoate CAS Name: dipotassium 5-[3-(4-oxido-4-oxobutyl)-2-tetradec-1-ynyl-2-oxiranyl]pentanoate IUPAC Name: dipotassium 5-[3-(4-oxido-4-oxobutyl)-2-tetradec-1-ynyloxiran-2-yl]pentanoate Traditional Name: dipotassium 5-[3-(4-keto-4-oxido-butyl)-2-tetradec-1-ynyl-oxiran-2-yl]valerate Formula: C25H40K2O5 MolecularWeight: 498.7787

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC#CC1(C(O1)CCCC(=O)[O-])CCCCC(=O)[O-].[K+].[K+]

Isomeric SMILES

CCCCCCCCCCCCC#CC1(C(O1)CCCC(=O)[O-])CCCCC(=O)[O-].[K+].[K+]

InChI

InChI=1S/C25H42O5.2K/c1-2-3-4-5-6-7-8-9-10-11-12-14-20-25(21-15-13-18-23(26)27)22(30-25)17-16-19-24(28)29;;/h22H,2-13,15-19,21H2,1H3,(H,26,27)(H,28,29);;/q;2*+1/p-2