[5-(hydroxymethyl)-4-oxidanyl-2-phenylmethoxy-oxolan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-(hydroxymethyl)-4-oxidanyl-2-phenylmethoxy-oxolan-3-yl] 4-methylbenzenesulfonate Openeye Name: [2-benzyloxy-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-hydroxy-5-(hydroxymethyl)-2-phenylmethoxy-3-oxolanyl] ester IUPAC Name: [4-hydroxy-5-(hydroxymethyl)-2-phenylmethoxyoxolan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-benzoxy-4-hydroxy-5-methylol-tetrahydrofuran-3-yl) ester Formula: C19H22O7S MolecularWeight: 394.43878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(C(OC2OCC3=CC=CC=C3)CO)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2C(C(OC2OCC3=CC=CC=C3)CO)O

InChI

InChI=1S/C19H22O7S/c1-13-7-9-15(10-8-13)27(22,23)26-18-17(21)16(11-20)25-19(18)24-12-14-5-3-2-4-6-14/h2-10,16-21H,11-12H2,1H3