(2,5-dimethylphenyl) 4-cyanobenzenesulfonate

Systemtic Name: (2,5-dimethylphenyl) 4-cyanobenzenesulfonate Openeye Name: (2,5-dimethylphenyl) 4-cyanobenzenesulfonate CAS Name: 4-cyanobenzenesulfonic acid (2,5-dimethylphenyl) ester IUPAC Name: (2,5-dimethylphenyl) 4-cyanobenzenesulfonate Traditional Name: 4-cyanobenzenesulfonic acid (2,5-dimethylphenyl) ester Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H13NO3S/c1-11-3-4-12(2)15(9-11)19-20(17,18)14-7-5-13(10-16)6-8-14/h3-9H,1-2H3