(3S,4S,6S)-2-(2-chloranyl-4-nitro-phenoxy)-6-methyl-oxane-3,4,5-triol

Systemtic Name: (3S,4S,6S)-2-(2-chloranyl-4-nitro-phenoxy)-6-methyl-oxane-3,4,5-triol Openeye Name: (3S,4S,6S)-2-(2-chloro-4-nitro-phenoxy)-6-methyl-tetrahydropyran-3,4,5-triol CAS Name: (3S,4S,6S)-2-(2-chloro-4-nitrophenoxy)-6-methyloxane-3,4,5-triol IUPAC Name: (3S,4S,6S)-2-(2-chloro-4-nitrophenoxy)-6-methyloxane-3,4,5-triol Traditional Name: (3S,4S,6S)-2-(2-chloro-4-nitro-phenoxy)-6-methyl-tetrahydropyran-3,4,5-triol Formula: C12H14ClNO7 MolecularWeight: 319.69506

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl)O)O)O

Isomeric SMILES

C[C@H]1C([C@@H]([C@@H](C(O1)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl)O)O)O

InChI

InChI=1S/C12H14ClNO7/c1-5-9(15)10(16)11(17)12(20-5)21-8-3-2-6(14(18)19)4-7(8)13/h2-5,9-12,15-17H,1H3/t5-,9?,10-,11-,12?/m0/s1