(3-chlorophenyl) 2,5-dimethylbenzenesulfonate

Systemtic Name: (3-chlorophenyl) 2,5-dimethylbenzenesulfonate Openeye Name: (3-chlorophenyl) 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid (3-chlorophenyl) ester Formula: C14H13ClO3S MolecularWeight: 296.76922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H13ClO3S/c1-10-6-7-11(2)14(8-10)19(16,17)18-13-5-3-4-12(15)9-13/h3-9H,1-2H3