1-adamantyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone

Systemtic Name: 1-adamantyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone Openeye Name: 1-adamantyl-(1-tetrahydrothiophen-1-ium-1-ylcyclohexyl)methanone CAS Name: 1-adamantyl-[1-(1-thiolan-1-iumyl)cyclohexyl]methanone IUPAC Name: 1-adamantyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone Traditional Name: 1-adamantyl-(1-tetrahydrothiophen-1-ium-1-ylcyclohexyl)methanone Formula: C21H33OS+ MolecularWeight: 333.55112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)C23CC4CC(C2)CC(C4)C3)[S+]5CCCC5

Isomeric SMILES

C1CCC(CC1)(C(=O)C23CC4CC(C2)CC(C4)C3)[S+]5CCCC5

InChI

InChI=1S/C21H33OS/c22-19(20-13-16-10-17(14-20)12-18(11-16)15-20)21(6-2-1-3-7-21)23-8-4-5-9-23/h16-18H,1-15H2/q+1