2,2-bis(bromanyl)-2-(3-methylphenyl)sulfonyl-ethanenitrile

Systemtic Name: 2,2-bis(bromanyl)-2-(3-methylphenyl)sulfonyl-ethanenitrile Openeye Name: 2,2-dibromo-2-(m-tolylsulfonyl)acetonitrile CAS Name: 2,2-dibromo-2-(3-methylphenyl)sulfonylacetonitrile IUPAC Name: 2,2-dibromo-2-(3-methylphenyl)sulfonylacetonitrile Traditional Name: 2,2-dibromo-2-(m-tolylsulfonyl)acetonitrile Formula: C9H7Br2NO2S MolecularWeight: 353.03038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7Br2NO2S/c1-7-3-2-4-8(5-7)15(13,14)9(10,11)6-12/h2-5H,1H3