[(3S)-3,4,5-triacetyloxy-6-(4-nitrophenoxy)-3-oxidanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [(3S)-3,4,5-triacetyloxy-6-(4-nitrophenoxy)-3-oxidanyl-oxan-2-yl]methyl ethanoate Openeye Name: [(3S)-3,4,5-triacetoxy-3-hydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(3S)-3,4,5-triacetyloxy-3-hydroxy-6-(4-nitrophenoxy)-2-oxanyl]methyl ester IUPAC Name: [(3S)-3,4,5-triacetyloxy-3-hydroxy-6-(4-nitrophenoxy)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(3S)-3,4,5-triacetoxy-3-hydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl ester Formula: C20H23NO13 MolecularWeight: 485.39552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C)OC(=O)C)(O)OC(=O)C

Isomeric SMILES

CC(=O)OCC1[C@](C(C(C(O1)OC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C)OC(=O)C)(O)OC(=O)C

InChI

InChI=1S/C20H23NO13/c1-10(22)29-9-16-20(26,34-13(4)25)18(31-12(3)24)17(30-11(2)23)19(33-16)32-15-7-5-14(6-8-15)21(27)28/h5-8,16-19,26H,9H2,1-4H3/t16?,17?,18?,19?,20-/m0/s1