phenyl 2,3,5,6-tetramethylbenzenesulfonate

Systemtic Name: phenyl 2,3,5,6-tetramethylbenzenesulfonate Openeye Name: phenyl 2,3,5,6-tetramethylbenzenesulfonate CAS Name: 2,3,5,6-tetramethylbenzenesulfonic acid phenyl ester IUPAC Name: phenyl 2,3,5,6-tetramethylbenzenesulfonate Traditional Name: 2,3,5,6-tetramethylbenzenesulfonic acid phenyl ester Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)OC2=CC=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)OC2=CC=CC=C2)C)C

InChI

InChI=1S/C16H18O3S/c1-11-10-12(2)14(4)16(13(11)3)20(17,18)19-15-8-6-5-7-9-15/h5-10H,1-4H3