2,5,7,8-tetramethyl-2-[2-(thiolan-1-ium-1-yl)ethyl]-3,4-dihydrochromen-6-ol bromide

Systemtic Name: 2,5,7,8-tetramethyl-2-[2-(thiolan-1-ium-1-yl)ethyl]-3,4-dihydrochromen-6-ol bromide Openeye Name: 2,5,7,8-tetramethyl-2-(2-tetrahydrothiophen-1-ium-1-ylethyl)chroman-6-ol bromide CAS Name: 2,5,7,8-tetramethyl-2-[2-(1-thiolan-1-iumyl)ethyl]-3,4-dihydro-2H-1-benzopyran-6-ol bromide IUPAC Name: 2,5,7,8-tetramethyl-2-[2-(thiolan-1-ium-1-yl)ethyl]-3,4-dihydrochromen-6-ol bromide Traditional Name: 2,5,7,8-tetramethyl-2-(2-tetrahydrothiophen-1-ium-1-ylethyl)chroman-6-ol bromide Formula: C19H29BrO2S MolecularWeight: 401.40136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(OC2=C1C)(C)CC[S+]3CCCC3)C)O.[Br-]

Isomeric SMILES

CC1=C(C(=C2CCC(OC2=C1C)(C)CC[S+]3CCCC3)C)O.[Br-]

InChI

InChI=1S/C19H28O2S.BrH/c1-13-14(2)18-16(15(3)17(13)20)7-8-19(4,21-18)9-12-22-10-5-6-11-22;/h5-12H2,1-4H3;1H