[(2R,3R,4S,5R,6R)-5-acetamido-3-oxidanyl-2-(phenylmethoxymethyl)-6-propoxy-oxan-4-yl] methanesulfonate

Systemtic Name: [(2R,3R,4S,5R,6R)-5-acetamido-3-oxidanyl-2-(phenylmethoxymethyl)-6-propoxy-oxan-4-yl] methanesulfonate Openeye Name: [(2R,3R,4S,5R,6R)-5-acetamido-2-(benzyloxymethyl)-3-hydroxy-6-propoxy-tetrahydropyran-4-yl] methanesulfonate CAS Name: methanesulfonic acid [(2R,3R,4S,5R,6R)-5-acetamido-3-hydroxy-2-(phenylmethoxymethyl)-6-propoxy-4-oxanyl] ester IUPAC Name: [(2R,3R,4S,5R,6R)-5-acetamido-3-hydroxy-2-(phenylmethoxymethyl)-6-propoxyoxan-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [(2R,3R,4S,5R,6R)-5-acetamido-2-(benzoxymethyl)-3-hydroxy-6-propoxy-tetrahydropyran-4-yl] ester Formula: C19H29NO8S MolecularWeight: 431.50046

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C(C(C(C(O1)COCC2=CC=CC=C2)O)OS(=O)(=O)C)NC(=O)C

Isomeric SMILES

CCCO[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)O)OS(=O)(=O)C)NC(=O)C

InChI

InChI=1S/C19H29NO8S/c1-4-10-26-19-16(20-13(2)21)18(28-29(3,23)24)17(22)15(27-19)12-25-11-14-8-6-5-7-9-14/h5-9,15-19,22H,4,10-12H2,1-3H3,(H,20,21)/t15-,16-,17-,18+,19-/m1/s1