(2S,3S,4S,5R,6S)-6-(2-acetamido-4-nitro-phenoxy)-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5R,6S)-6-(2-acetamido-4-nitro-phenoxy)-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5R,6S)-6-(2-acetamido-4-nitro-phenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5R,6S)-6-(2-acetamido-4-nitrophenoxy)-3,4,5-trihydroxy-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5R,6S)-6-(2-acetamido-4-nitrophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5R,6S)-6-(2-acetamido-4-nitro-phenoxy)-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid Formula: C14H16N2O10 MolecularWeight: 372.28424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC2C(C(C(C(O2)C(=O)O)O)O)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O

InChI

InChI=1S/C14H16N2O10/c1-5(17)15-7-4-6(16(23)24)2-3-8(7)25-14-11(20)9(18)10(19)12(26-14)13(21)22/h2-4,9-12,14,18-20H,1H3,(H,15,17)(H,21,22)/t9-,10-,11+,12-,14+/m0/s1