2-[(1S,2R)-2-(3,3-dimethylbut-1-ynyl)-1-(phenylsulfonyl)cyclopropyl]ethynylbenzene

Systemtic Name: 2-[(1S,2R)-2-(3,3-dimethylbut-1-ynyl)-1-(phenylsulfonyl)cyclopropyl]ethynylbenzene Openeye Name: 2-[(1S,2R)-1-(benzenesulfonyl)-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]ethynylbenzene CAS Name: 2-[(1S,2R)-1-(benzenesulfonyl)-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]ethynylbenzene IUPAC Name: 2-[(1S,2R)-1-(benzenesulfonyl)-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]ethynylbenzene Traditional Name: 2-[(1S,2R)-1-besyl-2-(3,3-dimethylbut-1-ynyl)cyclopropyl]ethynylbenzene Formula: C23H22O2S MolecularWeight: 362.48458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1CC1(C#CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C#C[C@H]1C[C@]1(C#CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H22O2S/c1-22(2,3)16-15-20-18-23(20,17-14-19-10-6-4-7-11-19)26(24,25)21-12-8-5-9-13-21/h4-13,20H,18H2,1-3H3/t20-,23-/m0/s1