3,3-dimethyl-2-(phenylsulfonyl)pent-4-enenitrile

Systemtic Name: 3,3-dimethyl-2-(phenylsulfonyl)pent-4-enenitrile Openeye Name: 2-(benzenesulfonyl)-3,3-dimethyl-pent-4-enenitrile CAS Name: 2-(benzenesulfonyl)-3,3-dimethyl-4-pentenenitrile IUPAC Name: 2-(benzenesulfonyl)-3,3-dimethylpent-4-enenitrile Traditional Name: 2-besyl-3,3-dimethyl-pent-4-enenitrile Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)C(C#N)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C=C)C(C#N)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H15NO2S/c1-4-13(2,3)12(10-14)17(15,16)11-8-6-5-7-9-11/h4-9,12H,1H2,2-3H3