(E)-6,6-dimethyl-5-(thiolan-1-ium-1-yl)hept-3-en-2-one

Systemtic Name: (E)-6,6-dimethyl-5-(thiolan-1-ium-1-yl)hept-3-en-2-one Openeye Name: (E)-6,6-dimethyl-5-tetrahydrothiophen-1-ium-1-yl-hept-3-en-2-one CAS Name: (E)-6,6-dimethyl-5-(1-thiolan-1-iumyl)-3-hepten-2-one IUPAC Name: (E)-6,6-dimethyl-5-(thiolan-1-ium-1-yl)hept-3-en-2-one Traditional Name: (E)-6,6-dimethyl-5-tetrahydrothiophen-1-ium-1-yl-hept-3-en-2-one Formula: C13H23OS+ MolecularWeight: 227.38612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23OS/c1-11(14)7-8-12(13(2,3)4)15-9-5-6-10-15/h7-8,12H,5-6,9-10H2,1-4H3/q+1/b8-7+