3-[2,5-bis(oxidanylidene)-4-undecyl-furan-3-yl]propanoic acid

Systemtic Name: 3-[2,5-bis(oxidanylidene)-4-undecyl-furan-3-yl]propanoic acid Openeye Name: 3-(2,5-dioxo-4-undecyl-3-furyl)propanoic acid CAS Name: 3-(2,5-dioxo-4-undecyl-3-furanyl)propanoic acid IUPAC Name: 3-(2,5-dioxo-4-undecylfuran-3-yl)propanoic acid Traditional Name: 3-(2,5-diketo-4-undecyl-3-furyl)propionic acid Formula: C18H28O5 MolecularWeight: 324.41192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=C(C(=O)OC1=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCC1=C(C(=O)OC1=O)CCC(=O)O

InChI

InChI=1S/C18H28O5/c1-2-3-4-5-6-7-8-9-10-11-14-15(12-13-16(19)20)18(22)23-17(14)21/h2-13H2,1H3,(H,19,20)