[(2R,3R,4S,5S)-4-azido-5-(hydroxymethyl)-2-methoxy-oxolan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2R,3R,4S,5S)-4-azido-5-(hydroxymethyl)-2-methoxy-oxolan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(2R,3R,4S,5S)-4-azido-5-(hydroxymethyl)-2-methoxy-tetrahydrofuran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3R,4S,5S)-4-azido-5-(hydroxymethyl)-2-methoxy-3-oxolanyl] ester IUPAC Name: [(2R,3R,4S,5S)-4-azido-5-(hydroxymethyl)-2-methoxyoxolan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3R,4S,5S)-4-azido-2-methoxy-5-methylol-tetrahydrofuran-3-yl] ester Formula: C13H17N3O6S MolecularWeight: 343.35558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(C(OC2OC)CO)N=[N+]=[N-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2[C@H]([C@H](O[C@H]2OC)CO)N=[N+]=[N-]

InChI

InChI=1S/C13H17N3O6S/c1-8-3-5-9(6-4-8)23(18,19)22-12-11(15-16-14)10(7-17)21-13(12)20-2/h3-6,10-13,17H,7H2,1-2H3/t10-,11+,12-,13-/m1/s1