3-(1-adamantyl)-1,1,1-tris(fluoranyl)-4-(furan-2-yl)-4-oxidanyl-but-3-en-2-one

Systemtic Name: 3-(1-adamantyl)-1,1,1-tris(fluoranyl)-4-(furan-2-yl)-4-oxidanyl-but-3-en-2-one Openeye Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-(2-furyl)-4-hydroxy-but-3-en-2-one CAS Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-(2-furanyl)-4-hydroxy-3-buten-2-one IUPAC Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-(furan-2-yl)-4-hydroxybut-3-en-2-one Traditional Name: 3-(1-adamantyl)-1,1,1-trifluoro-4-(2-furyl)-4-hydroxy-but-3-en-2-one Formula: C18H19F3O3 MolecularWeight: 340.33687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=C(C4=CC=CO4)O)C(=O)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=C(C4=CC=CO4)O)C(=O)C(F)(F)F

InChI

InChI=1S/C18H19F3O3/c19-18(20,21)16(23)14(15(22)13-2-1-3-24-13)17-7-10-4-11(8-17)6-12(5-10)9-17/h1-3,10-12,22H,4-9H2