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

Systemtic Name: [(2R,3S,4R,5R,6S)-5-acetamido-6-(4-nitrophenoxy)-3,4-bis(oxidanyl)oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5R,6S)-5-acetamido-3,4-dihydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5R,6S)-5-acetamido-3,4-dihydroxy-6-(4-nitrophenoxy)-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R,6S)-5-acetamido-3,4-dihydroxy-6-(4-nitrophenoxy)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6S)-5-acetamido-3,4-dihydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl ester Formula: C16H20N2O9 MolecularWeight: 384.338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)[N+](=O)[O-])COC(=O)C)O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O9/c1-8(19)17-13-15(22)14(21)12(7-25-9(2)20)27-16(13)26-11-5-3-10(4-6-11)18(23)24/h3-6,12-16,21-22H,7H2,1-2H3,(H,17,19)/t12-,13-,14-,15-,16-/m1/s1