methyl 3-[(4S,5R,6R)-6-(acetyloxymethyl)-4-azido-6-methoxy-5-oxidanyl-1,2-oxazinan-2-yl]-4-iodanyl-5-methoxy-benzoate

Systemtic Name: methyl 3-[(4S,5R,6R)-6-(acetyloxymethyl)-4-azido-6-methoxy-5-oxidanyl-1,2-oxazinan-2-yl]-4-iodanyl-5-methoxy-benzoate Openeye Name: methyl 3-[(4S,5R,6R)-6-(acetoxymethyl)-4-azido-5-hydroxy-6-methoxy-oxazinan-2-yl]-4-iodo-5-methoxy-benzoate CAS Name: 3-[(4S,5R,6R)-6-(acetyloxymethyl)-4-azido-5-hydroxy-6-methoxy-2-oxazinanyl]-4-iodo-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-[(4S,5R,6R)-6-(acetyloxymethyl)-4-azido-5-hydroxy-6-methoxyoxazinan-2-yl]-4-iodo-5-methoxybenzoate Traditional Name: 3-[(4S,5R,6R)-6-(acetoxymethyl)-4-azido-5-hydroxy-6-methoxy-oxazinan-2-yl]-4-iodo-5-methoxy-benzoic acid methyl ester Formula: C17H21IN4O8 MolecularWeight: 536.27511

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(C(CN(O1)C2=C(C(=CC(=C2)C(=O)OC)OC)I)N=[N+]=[N-])O)OC

Isomeric SMILES

CC(=O)OC[C@@]1([C@@H]([C@H](CN(O1)C2=C(C(=CC(=C2)C(=O)OC)OC)I)N=[N+]=[N-])O)OC

InChI

InChI=1S/C17H21IN4O8/c1-9(23)29-8-17(28-4)15(24)11(20-21-19)7-22(30-17)12-5-10(16(25)27-3)6-13(26-2)14(12)18/h5-6,11,15,24H,7-8H2,1-4H3/t11-,15+,17+/m0/s1