5-methyl-2-(phenylsulfonyl)hex-4-enenitrile

Systemtic Name: 5-methyl-2-(phenylsulfonyl)hex-4-enenitrile Openeye Name: 2-(benzenesulfonyl)-5-methyl-hex-4-enenitrile CAS Name: 2-(benzenesulfonyl)-5-methyl-4-hexenenitrile IUPAC Name: 2-(benzenesulfonyl)-5-methylhex-4-enenitrile Traditional Name: 2-besyl-5-methyl-hex-4-enenitrile Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO2S/c1-11(2)8-9-13(10-14)17(15,16)12-6-4-3-5-7-12/h3-8,13H,9H2,1-2H3