(4-chloranyl-3,5-dimethyl-phenyl) 2-chloranylbenzenesulfonate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 2-chloranylbenzenesulfonate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 2-chlorobenzenesulfonate CAS Name: 2-chlorobenzenesulfonic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 2-chlorobenzenesulfonate Traditional Name: 2-chlorobenzenesulfonic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C14H12Cl2O3S MolecularWeight: 331.21428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OS(=O)(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OS(=O)(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C14H12Cl2O3S/c1-9-7-11(8-10(2)14(9)16)19-20(17,18)13-6-4-3-5-12(13)15/h3-8H,1-2H3