methyl (5R)-3-[(3S,4S,5R,6S,7R)-4,5,6,7,8-pentaacetyloxy-1-oxidanylidene-octan-3-yl]-4,5-dihydro-1,2-oxazole-5-carboxylate

Systemtic Name: methyl (5R)-3-[(3S,4S,5R,6S,7R)-4,5,6,7,8-pentaacetyloxy-1-oxidanylidene-octan-3-yl]-4,5-dihydro-1,2-oxazole-5-carboxylate Openeye Name: methyl (5R)-3-[(1S,2S,3R,4S,5R)-2,3,4,5,6-pentaacetoxy-1-(2-oxoethyl)hexyl]-4,5-dihydroisoxazole-5-carboxylate CAS Name: (5R)-3-[(3S,4S,5R,6S,7R)-4,5,6,7,8-pentaacetyloxy-1-oxooctan-3-yl]-4,5-dihydroisoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl (5R)-3-[(3S,4S,5R,6S,7R)-4,5,6,7,8-pentaacetyloxy-1-oxooctan-3-yl]-4,5-dihydro-1,2-oxazole-5-carboxylate Traditional Name: (5R)-3-[(1S,2S,3R,4S,5R)-2,3,4,5,6-pentaacetoxy-1-(2-ketoethyl)hexyl]-2-isoxazoline-5-carboxylic acid methyl ester Formula: C23H31NO14 MolecularWeight: 545.49054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C(C(C(CC=O)C1=NOC(C1)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@H]([C@@H]([C@@H]([C@H]([C@@H](CC=O)C1=NO[C@H](C1)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C23H31NO14/c1-11(26)33-10-19(34-12(2)27)21(36-14(4)29)22(37-15(5)30)20(35-13(3)28)16(7-8-25)17-9-18(38-24-17)23(31)32-6/h8,16,18-22H,7,9-10H2,1-6H3/t16-,18+,19+,20-,21-,22+/m0/s1