(2-chlorophenyl) 2,4,5-trimethylbenzenesulfonate

Systemtic Name: (2-chlorophenyl) 2,4,5-trimethylbenzenesulfonate Openeye Name: (2-chlorophenyl) 2,4,5-trimethylbenzenesulfonate CAS Name: 2,4,5-trimethylbenzenesulfonic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 2,4,5-trimethylbenzenesulfonate Traditional Name: 2,4,5-trimethylbenzenesulfonic acid (2-chlorophenyl) ester Formula: C15H15ClO3S MolecularWeight: 310.7958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)OC2=CC=CC=C2Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)OC2=CC=CC=C2Cl)C

InChI

InChI=1S/C15H15ClO3S/c1-10-8-12(3)15(9-11(10)2)20(17,18)19-14-7-5-4-6-13(14)16/h4-9H,1-3H3