(2S)-2-[(2R)-7-nitro-6-oxidanyl-2,3-dihydro-1-benzofuran-2-yl]propane-1,2-diol

Systemtic Name: (2S)-2-[(2R)-7-nitro-6-oxidanyl-2,3-dihydro-1-benzofuran-2-yl]propane-1,2-diol Openeye Name: (2S)-2-[(2R)-6-hydroxy-7-nitro-2,3-dihydrobenzofuran-2-yl]propane-1,2-diol CAS Name: (2S)-2-[(2R)-6-hydroxy-7-nitro-2,3-dihydrobenzofuran-2-yl]propane-1,2-diol IUPAC Name: (2S)-2-[(2R)-6-hydroxy-7-nitro-2,3-dihydro-1-benzofuran-2-yl]propane-1,2-diol Traditional Name: (2S)-2-[(2R)-6-hydroxy-7-nitro-coumaran-2-yl]propane-1,2-diol Formula: C11H13NO6 MolecularWeight: 255.22402

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C1CC2=C(O1)C(=C(C=C2)O)[N+](=O)[O-])O

Isomeric SMILES

C[C@](CO)([C@H]1CC2=C(O1)C(=C(C=C2)O)[N+](=O)[O-])O

InChI

InChI=1S/C11H13NO6/c1-11(15,5-13)8-4-6-2-3-7(14)9(12(16)17)10(6)18-8/h2-3,8,13-15H,4-5H2,1H3/t8-,11+/m1/s1