[2,6-bis(hydroxymethyl)-4-methyl-phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2,6-bis(hydroxymethyl)-4-methyl-phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-bis(hydroxymethyl)-4-methyl-phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,6-bis(hydroxymethyl)-4-methylphenyl] ester IUPAC Name: [2,6-bis(hydroxymethyl)-4-methylphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-methyl-2,6-dimethylol-phenyl) ester Formula: C16H18O5S MolecularWeight: 322.37612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2CO)C)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2CO)C)CO

InChI

InChI=1S/C16H18O5S/c1-11-3-5-15(6-4-11)22(19,20)21-16-13(9-17)7-12(2)8-14(16)10-18/h3-8,17-18H,9-10H2,1-2H3