[(E)-1,2-dicyanoethenyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-1,2-dicyanoethenyl] 4-methylbenzenesulfonate Openeye Name: [(E)-1,2-dicyanovinyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-1,2-dicyanoethenyl] ester IUPAC Name: [(E)-1,2-dicyanoethenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-1,2-dicyanovinyl] ester Formula: C11H8N2O3S MolecularWeight: 248.25782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N2O3S/c1-9-2-4-11(5-3-9)17(14,15)16-10(8-13)6-7-12/h2-6H,1H3/b10-6+