[(2R,3S,4S,5R,6R)-5-acetamido-3-oxidanyl-6-phenylmethoxy-4-prop-2-enoxy-oxan-2-yl]methyl benzoate

Systemtic Name: [(2R,3S,4S,5R,6R)-5-acetamido-3-oxidanyl-6-phenylmethoxy-4-prop-2-enoxy-oxan-2-yl]methyl benzoate Openeye Name: [(2R,3S,4S,5R,6R)-5-acetamido-4-allyloxy-6-benzyloxy-3-hydroxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3S,4S,5R,6R)-5-acetamido-3-hydroxy-6-phenylmethoxy-4-prop-2-enoxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4S,5R,6R)-5-acetamido-3-hydroxy-6-phenylmethoxy-4-prop-2-enoxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3S,4S,5R,6R)-5-acetamido-4-allyloxy-6-benzoxy-3-hydroxy-tetrahydropyran-2-yl]methyl ester Formula: C25H29NO7 MolecularWeight: 455.50026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OCC2=CC=CC=C2)COC(=O)C3=CC=CC=C3)O)OCC=C

Isomeric SMILES

CC(=O)N[C@@H]1[C@@H]([C@@H]([C@H](O[C@H]1OCC2=CC=CC=C2)COC(=O)C3=CC=CC=C3)O)OCC=C

InChI

InChI=1S/C25H29NO7/c1-3-14-30-23-21(26-17(2)27)25(32-15-18-10-6-4-7-11-18)33-20(22(23)28)16-31-24(29)19-12-8-5-9-13-19/h3-13,20-23,25,28H,1,14-16H2,2H3,(H,26,27)/t20-,21-,22-,23+,25-/m1/s1