(E)-5-ethyl-3,3-dimethyl-8-oxidanyl-2-oxidanylidene-4-pyrrolidin-1-yl-8-[5-(trifluoromethyl)furan-2-yl]oct-6-enoic acid

Systemtic Name: (E)-5-ethyl-3,3-dimethyl-8-oxidanyl-2-oxidanylidene-4-pyrrolidin-1-yl-8-[5-(trifluoromethyl)furan-2-yl]oct-6-enoic acid Openeye Name: (E)-5-ethyl-8-hydroxy-3,3-dimethyl-2-oxo-4-pyrrolidin-1-yl-8-[5-(trifluoromethyl)-2-furyl]oct-6-enoic acid CAS Name: (E)-5-ethyl-8-hydroxy-3,3-dimethyl-2-oxo-4-(1-pyrrolidinyl)-8-[5-(trifluoromethyl)-2-furanyl]-6-octenoic acid IUPAC Name: (E)-5-ethyl-8-hydroxy-3,3-dimethyl-2-oxo-4-pyrrolidin-1-yl-8-[5-(trifluoromethyl)furan-2-yl]oct-6-enoic acid Traditional Name: (E)-5-ethyl-8-hydroxy-2-keto-3,3-dimethyl-4-pyrrolidino-8-[5-(trifluoromethyl)-2-furyl]oct-6-enoic acid Formula: C21H28F3NO5 MolecularWeight: 431.44593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C=CC(C1=CC=C(O1)C(F)(F)F)O)C(C(C)(C)C(=O)C(=O)O)N2CCCC2

Isomeric SMILES

CCC(/C=C/C(C1=CC=C(O1)C(F)(F)F)O)C(C(C)(C)C(=O)C(=O)O)N2CCCC2

InChI

InChI=1S/C21H28F3NO5/c1-4-13(7-8-14(26)15-9-10-16(30-15)21(22,23)24)17(25-11-5-6-12-25)20(2,3)18(27)19(28)29/h7-10,13-14,17,26H,4-6,11-12H2,1-3H3,(H,28,29)/b8-7+