(E)-3-(2-methylphenyl)-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-methylphenyl)-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-2-methylsulfonyl-3-(o-tolyl)prop-2-enenitrile CAS Name: (E)-3-(2-methylphenyl)-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(2-methylphenyl)-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-2-mesyl-3-(o-tolyl)acrylonitrile Formula: C11H11NO2S MolecularWeight: 221.27554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C#N)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO2S/c1-9-5-3-4-6-10(9)7-11(8-12)15(2,13)14/h3-7H,1-2H3/b11-7+