[2-(3,3-dimethylbut-1-ynyl)-1-(phenylsulfonyl)cyclopropyl]sulfonylbenzene

Systemtic Name: [2-(3,3-dimethylbut-1-ynyl)-1-(phenylsulfonyl)cyclopropyl]sulfonylbenzene Openeye Name: [1-(benzenesulfonyl)-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]sulfonylbenzene CAS Name: [1-(benzenesulfonyl)-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]sulfonylbenzene IUPAC Name: [1-(benzenesulfonyl)-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]sulfonylbenzene Traditional Name: [1-besyl-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]sulfonylbenzene Formula: C21H22O4S2 MolecularWeight: 402.52698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1CC1(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C#CC1CC1(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O4S2/c1-20(2,3)15-14-17-16-21(17,26(22,23)18-10-6-4-7-11-18)27(24,25)19-12-8-5-9-13-19/h4-13,17H,16H2,1-3H3