1-(1-adamantyl)-2-phenyl-2-(thiolan-1-ium-1-yl)ethanone

Systemtic Name: 1-(1-adamantyl)-2-phenyl-2-(thiolan-1-ium-1-yl)ethanone Openeye Name: 1-(1-adamantyl)-2-phenyl-2-tetrahydrothiophen-1-ium-1-yl-ethanone CAS Name: 1-(1-adamantyl)-2-phenyl-2-(1-thiolan-1-iumyl)ethanone IUPAC Name: 1-(1-adamantyl)-2-phenyl-2-(thiolan-1-ium-1-yl)ethanone Traditional Name: 1-(1-adamantyl)-2-phenyl-2-tetrahydrothiophen-1-ium-1-yl-ethanone Formula: C22H29OS+ MolecularWeight: 341.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[S+](C1)C(C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC[S+](C1)C(C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H29OS/c23-21(22-13-16-10-17(14-22)12-18(11-16)15-22)20(24-8-4-5-9-24)19-6-2-1-3-7-19/h1-3,6-7,16-18,20H,4-5,8-15H2/q+1