2-[5-[(E)-octadec-9-enoxy]furan-3-yl]carbonyl-3-oxidanylidene-butanoic acid

Systemtic Name: 2-[5-[(E)-octadec-9-enoxy]furan-3-yl]carbonyl-3-oxidanylidene-butanoic acid Openeye Name: 2-[5-[(E)-octadec-9-enoxy]furan-3-carbonyl]-3-oxo-butanoic acid CAS Name: 2-[[5-[(E)-octadec-9-enoxy]-3-furanyl]-oxomethyl]-3-oxobutanoic acid IUPAC Name: 2-[5-[(E)-octadec-9-enoxy]furan-3-carbonyl]-3-oxobutanoic acid Traditional Name: 3-keto-2-[5-[(E)-octadec-9-enoxy]-3-furoyl]butyric acid Formula: C27H42O6 MolecularWeight: 462.61878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC1=CC(=CO1)C(=O)C(C(=O)C)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC1=CC(=CO1)C(=O)C(C(=O)C)C(=O)O

InChI

InChI=1S/C27H42O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32-24-20-23(21-33-24)26(29)25(22(2)28)27(30)31/h10-11,20-21,25H,3-9,12-19H2,1-2H3,(H,30,31)/b11-10+