2-(2,5-dimethylphenyl)sulfonylethanenitrile

Systemtic Name: 2-(2,5-dimethylphenyl)sulfonylethanenitrile Openeye Name: 2-(2,5-dimethylphenyl)sulfonylacetonitrile CAS Name: 2-(2,5-dimethylphenyl)sulfonylacetonitrile IUPAC Name: 2-(2,5-dimethylphenyl)sulfonylacetonitrile Traditional Name: 2-(2,5-dimethylphenyl)sulfonylacetonitrile Formula: C10H11NO2S MolecularWeight: 209.26484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO2S/c1-8-3-4-9(2)10(7-8)14(12,13)6-5-11/h3-4,7H,6H2,1-2H3