(2,6-dimethylphenyl)methyl 4-methylbenzenesulfonate

Systemtic Name: (2,6-dimethylphenyl)methyl 4-methylbenzenesulfonate Openeye Name: (2,6-dimethylphenyl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2,6-dimethylphenyl)methyl ester IUPAC Name: (2,6-dimethylphenyl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2,6-dimethylbenzyl) ester Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C(C=CC=C2C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C(C=CC=C2C)C

InChI

InChI=1S/C16H18O3S/c1-12-7-9-15(10-8-12)20(17,18)19-11-16-13(2)5-4-6-14(16)3/h4-10H,11H2,1-3H3