3,5-bis(methylsulfonyl)benzenecarbonitrile

Systemtic Name: 3,5-bis(methylsulfonyl)benzenecarbonitrile Openeye Name: 3,5-bis(methylsulfonyl)benzonitrile CAS Name: 3,5-bis(methylsulfonyl)benzonitrile IUPAC Name: 3,5-bis(methylsulfonyl)benzonitrile Traditional Name: 3,5-dimesylbenzonitrile Formula: C9H9NO4S2 MolecularWeight: 259.30206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO4S2/c1-15(11,12)8-3-7(6-10)4-9(5-8)16(2,13)14/h3-5H,1-2H3