[(1R,2S)-2-(3,3-dimethylbut-1-ynyl)-1-methylsulfonyl-cyclopropyl]sulfonylbenzene

Systemtic Name: [(1R,2S)-2-(3,3-dimethylbut-1-ynyl)-1-methylsulfonyl-cyclopropyl]sulfonylbenzene Openeye Name: [(1R,2S)-2-(3,3-dimethylbut-1-ynyl)-1-methylsulfonyl-cyclopropyl]sulfonylbenzene CAS Name: [(1R,2S)-2-(3,3-dimethylbut-1-ynyl)-1-methylsulfonylcyclopropyl]sulfonylbenzene IUPAC Name: [(1R,2S)-2-(3,3-dimethylbut-1-ynyl)-1-methylsulfonylcyclopropyl]sulfonylbenzene Traditional Name: [(1R,2S)-2-(3,3-dimethylbut-1-ynyl)-1-mesyl-cyclopropyl]sulfonylbenzene Formula: C16H20O4S2 MolecularWeight: 340.4576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1CC1(S(=O)(=O)C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C#C[C@@H]1C[C@@]1(S(=O)(=O)C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20O4S2/c1-15(2,3)11-10-13-12-16(13,21(4,17)18)22(19,20)14-8-6-5-7-9-14/h5-9,13H,12H2,1-4H3/t13-,16-/m1/s1