2,2-bis(methylsulfonyl)ethanenitrile

Systemtic Name: 2,2-bis(methylsulfonyl)ethanenitrile Openeye Name: 2,2-bis(methylsulfonyl)acetonitrile CAS Name: 2,2-bis(methylsulfonyl)acetonitrile IUPAC Name: 2,2-bis(methylsulfonyl)acetonitrile Traditional Name: 2,2-dimesylacetonitrile Formula: C4H7NO4S2 MolecularWeight: 197.23268

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(C#N)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C(C#N)S(=O)(=O)C

InChI

InChI=1S/C4H7NO4S2/c1-10(6,7)4(3-5)11(2,8)9/h4H,1-2H3