3-methyl-1-phenyl-2-(thiolan-1-ium-1-yl)butan-1-one

Systemtic Name: 3-methyl-1-phenyl-2-(thiolan-1-ium-1-yl)butan-1-one Openeye Name: 3-methyl-1-phenyl-2-tetrahydrothiophen-1-ium-1-yl-butan-1-one CAS Name: 3-methyl-1-phenyl-2-(1-thiolan-1-iumyl)-1-butanone IUPAC Name: 3-methyl-1-phenyl-2-(thiolan-1-ium-1-yl)butan-1-one Traditional Name: 3-methyl-1-phenyl-2-tetrahydrothiophen-1-ium-1-yl-butan-1-one Formula: C15H21OS+ MolecularWeight: 249.39164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C1=CC=CC=C1)[S+]2CCCC2

Isomeric SMILES

CC(C)C(C(=O)C1=CC=CC=C1)[S+]2CCCC2

InChI

InChI=1S/C15H21OS/c1-12(2)15(17-10-6-7-11-17)14(16)13-8-4-3-5-9-13/h3-5,8-9,12,15H,6-7,10-11H2,1-2H3/q+1