[3-(hydroxymethyl)cyclobutyl] 4-methylbenzenesulfonate

Systemtic Name: [3-(hydroxymethyl)cyclobutyl] 4-methylbenzenesulfonate Openeye Name: [3-(hydroxymethyl)cyclobutyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(hydroxymethyl)cyclobutyl] ester IUPAC Name: [3-(hydroxymethyl)cyclobutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-methylolcyclobutyl) ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C2)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C2)CO

InChI

InChI=1S/C12H16O4S/c1-9-2-4-12(5-3-9)17(14,15)16-11-6-10(7-11)8-13/h2-5,10-11,13H,6-8H2,1H3