methyl (3S,6S)-3,4,5-triacetyloxy-6-(2-nitrophenoxy)oxane-2-carboxylate

Systemtic Name: methyl (3S,6S)-3,4,5-triacetyloxy-6-(2-nitrophenoxy)oxane-2-carboxylate Openeye Name: methyl (3S,6S)-3,4,5-triacetoxy-6-(2-nitrophenoxy)tetrahydropyran-2-carboxylate CAS Name: (3S,6S)-3,4,5-triacetyloxy-6-(2-nitrophenoxy)-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (3S,6S)-3,4,5-triacetyloxy-6-(2-nitrophenoxy)oxane-2-carboxylate Traditional Name: (3S,6S)-3,4,5-triacetoxy-6-(2-nitrophenoxy)tetrahydropyran-2-carboxylic acid methyl ester Formula: C19H21NO12 MolecularWeight: 455.36954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC(C1OC(=O)C)OC2=CC=CC=C2[N+](=O)[O-])C(=O)OC)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H]1C(C([C@@H](OC1C(=O)OC)OC2=CC=CC=C2[N+](=O)[O-])OC(=O)C)OC(=O)C

InChI

InChI=1S/C19H21NO12/c1-9(21)28-14-15(29-10(2)22)17(30-11(3)23)19(32-16(14)18(24)27-4)31-13-8-6-5-7-12(13)20(25)26/h5-8,14-17,19H,1-4H3/t14-,15?,16?,17?,19+/m0/s1