methyl (2S,3S,4R,5E,6R)-3,4-diacetyloxy-6-bromanyl-5-(phenylcarbonyloxyimino)oxane-2-carboxylate

Systemtic Name: methyl (2S,3S,4R,5E,6R)-3,4-diacetyloxy-6-bromanyl-5-(phenylcarbonyloxyimino)oxane-2-carboxylate Openeye Name: methyl (2S,3S,4R,5E,6R)-3,4-diacetoxy-5-benzoyloxyimino-6-bromo-tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4R,5E,6R)-3,4-diacetyloxy-5-benzoyloxyimino-6-bromo-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5E,6R)-3,4-diacetyloxy-5-benzoyloxyimino-6-bromooxane-2-carboxylate Traditional Name: (2S,3S,4R,5E,6R)-3,4-diacetoxy-5-benzoyloximino-6-bromo-tetrahydropyran-2-carboxylic acid methyl ester Formula: C18H18BrNO9 MolecularWeight: 472.24082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(=NOC(=O)C2=CC=CC=C2)C(OC1C(=O)OC)Br)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H]1[C@@H](/C(=N\OC(=O)C2=CC=CC=C2)/[C@H](O[C@@H]1C(=O)OC)Br)OC(=O)C

InChI

InChI=1S/C18H18BrNO9/c1-9(21)26-13-12(20-29-17(23)11-7-5-4-6-8-11)16(19)28-15(18(24)25-3)14(13)27-10(2)22/h4-8,13-16H,1-3H3/b20-12+/t13-,14+,15+,16+/m1/s1