methyl 4-methylbenzenesulfonate

Systemtic Name: methyl 4-methylbenzenesulfonate Openeye Name: methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid methyl ester IUPAC Name: methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid methyl ester Formula: C8H10O3S MolecularWeight: 186.2282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC

InChI

InChI=1S/C8H10O3S/c1-7-3-5-8(6-4-7)12(9,10)11-2/h3-6H,1-2H3