[(2S,3S,4R,5R,6S)-4-acetyloxy-6-bromanyl-2-methyl-5-phenylmethoxy-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3S,4R,5R,6S)-4-acetyloxy-6-bromanyl-2-methyl-5-phenylmethoxy-oxan-3-yl] ethanoate Openeye Name: [(2S,3S,4R,5R,6S)-4-acetoxy-5-benzyloxy-6-bromo-2-methyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3S,4R,5R,6S)-4-acetyloxy-6-bromo-2-methyl-5-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4R,5R,6S)-4-acetyloxy-6-bromo-2-methyl-5-phenylmethoxyoxan-3-yl] acetate Traditional Name: acetic acid [(2S,3S,4R,5R,6S)-4-acetoxy-5-benzoxy-6-bromo-2-methyl-tetrahydropyran-3-yl] ester Formula: C17H21BrO6 MolecularWeight: 401.24904

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)Br)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)Br)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C

InChI

InChI=1S/C17H21BrO6/c1-10-14(23-11(2)19)15(24-12(3)20)16(17(18)22-10)21-9-13-7-5-4-6-8-13/h4-8,10,14-17H,9H2,1-3H3/t10-,14-,15+,16+,17+/m0/s1