3-(2,4,6-trimethylphenyl)sulfonylpropanenitrile

Systemtic Name: 3-(2,4,6-trimethylphenyl)sulfonylpropanenitrile Openeye Name: 3-(2,4,6-trimethylphenyl)sulfonylpropanenitrile CAS Name: 3-(2,4,6-trimethylphenyl)sulfonylpropanenitrile IUPAC Name: 3-(2,4,6-trimethylphenyl)sulfonylpropanenitrile Traditional Name: 3-mesitylsulfonylpropionitrile Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)CCC#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)CCC#N)C

InChI

InChI=1S/C12H15NO2S/c1-9-7-10(2)12(11(3)8-9)16(14,15)6-4-5-13/h7-8H,4,6H2,1-3H3