(E)-5-methyl-1-(thiolan-1-ium-1-yl)hex-3-en-2-one

Systemtic Name: (E)-5-methyl-1-(thiolan-1-ium-1-yl)hex-3-en-2-one Openeye Name: (E)-5-methyl-1-tetrahydrothiophen-1-ium-1-yl-hex-3-en-2-one CAS Name: (E)-5-methyl-1-(1-thiolan-1-iumyl)-3-hexen-2-one IUPAC Name: (E)-5-methyl-1-(thiolan-1-ium-1-yl)hex-3-en-2-one Traditional Name: (E)-5-methyl-1-tetrahydrothiophen-1-ium-1-yl-hex-3-en-2-one Formula: C11H19OS+ MolecularWeight: 199.33296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19OS/c1-10(2)5-6-11(12)9-13-7-3-4-8-13/h5-6,10H,3-4,7-9H2,1-2H3/q+1/b6-5+