2-(1-adamantyl)-4,4,4-tris(fluoranyl)-1-thiophen-2-yl-butane-1,3-dione

Systemtic Name: 2-(1-adamantyl)-4,4,4-tris(fluoranyl)-1-thiophen-2-yl-butane-1,3-dione Openeye Name: 2-(1-adamantyl)-4,4,4-trifluoro-1-(2-thienyl)butane-1,3-dione CAS Name: 2-(1-adamantyl)-4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione IUPAC Name: 2-(1-adamantyl)-4,4,4-trifluoro-1-thiophen-2-ylbutane-1,3-dione Traditional Name: 2-(1-adamantyl)-4,4,4-trifluoro-1-(2-thienyl)butane-1,3-dione Formula: C18H19F3O2S MolecularWeight: 356.40247

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C(=O)C4=CC=CS4)C(=O)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(C(=O)C4=CC=CS4)C(=O)C(F)(F)F

InChI

InChI=1S/C18H19F3O2S/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/h1-3,10-12,14H,4-9H2