4-[[2-dodecanoyloxy-2-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)ethyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-dodecanoyloxy-2-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)ethyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-dodecanoyloxy-2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[2-(2-hydroxy-5-oxo-2H-furan-3-yl)-2-(1-oxododecoxy)ethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[2-dodecanoyloxy-2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]amino]-4-oxobutanoic acid Traditional Name: 4-[[2-(2-hydroxy-5-keto-2H-furan-3-yl)-2-lauroyloxy-ethyl]amino]-4-keto-butyric acid Formula: C22H35NO8 MolecularWeight: 441.5152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(CNC(=O)CCC(=O)O)C1=CC(=O)OC1O

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(CNC(=O)CCC(=O)O)C1=CC(=O)OC1O

InChI

InChI=1S/C22H35NO8/c1-2-3-4-5-6-7-8-9-10-11-20(27)30-17(16-14-21(28)31-22(16)29)15-23-18(24)12-13-19(25)26/h14,17,22,29H,2-13,15H2,1H3,(H,23,24)(H,25,26)