[(2R,3R,4S,6S)-2-methoxy-3-oxidanyl-6-(phenylmethoxymethyl)oxan-4-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2R,3R,4S,6S)-2-methoxy-3-oxidanyl-6-(phenylmethoxymethyl)oxan-4-yl] 4-methylbenzenesulfonate Openeye Name: [(2R,3R,4S,6S)-6-(benzyloxymethyl)-3-hydroxy-2-methoxy-tetrahydropyran-4-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3R,4S,6S)-3-hydroxy-2-methoxy-6-(phenylmethoxymethyl)-4-oxanyl] ester IUPAC Name: [(2R,3R,4S,6S)-3-hydroxy-2-methoxy-6-(phenylmethoxymethyl)oxan-4-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3R,4S,6S)-6-(benzoxymethyl)-3-hydroxy-2-methoxy-tetrahydropyran-4-yl] ester Formula: C21H26O7S MolecularWeight: 422.49194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(OC(C2O)OC)COCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2C[C@H](O[C@H]([C@@H]2O)OC)COCC3=CC=CC=C3

InChI

InChI=1S/C21H26O7S/c1-15-8-10-18(11-9-15)29(23,24)28-19-12-17(27-21(25-2)20(19)22)14-26-13-16-6-4-3-5-7-16/h3-11,17,19-22H,12-14H2,1-2H3/t17-,19-,20+,21+/m0/s1