2,6-dimethyl-3-(thiolan-1-ium-1-yl)heptan-4-one

Systemtic Name: 2,6-dimethyl-3-(thiolan-1-ium-1-yl)heptan-4-one Openeye Name: 2,6-dimethyl-3-tetrahydrothiophen-1-ium-1-yl-heptan-4-one CAS Name: 2,6-dimethyl-3-(1-thiolan-1-iumyl)-4-heptanone IUPAC Name: 2,6-dimethyl-3-(thiolan-1-ium-1-yl)heptan-4-one Traditional Name: 2,6-dimethyl-3-tetrahydrothiophen-1-ium-1-yl-heptan-4-one Formula: C13H25OS+ MolecularWeight: 229.402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C)C)[S+]1CCCC1

Isomeric SMILES

CC(C)CC(=O)C(C(C)C)[S+]1CCCC1

InChI

InChI=1S/C13H25OS/c1-10(2)9-12(14)13(11(3)4)15-7-5-6-8-15/h10-11,13H,5-9H2,1-4H3/q+1