(3S,5R,6R)-5,6-dimethoxy-5,6-dimethyl-3-[(1R,2S)-2-nitrocyclohexyl]-1,4-dioxan-2-one

Systemtic Name: (3S,5R,6R)-5,6-dimethoxy-5,6-dimethyl-3-[(1R,2S)-2-nitrocyclohexyl]-1,4-dioxan-2-one Openeye Name: (3S,5R,6R)-5,6-dimethoxy-5,6-dimethyl-3-[(1R,2S)-2-nitrocyclohexyl]-1,4-dioxan-2-one CAS Name: (3S,5R,6R)-5,6-dimethoxy-5,6-dimethyl-3-[(1R,2S)-2-nitrocyclohexyl]-1,4-dioxan-2-one IUPAC Name: (3S,5R,6R)-5,6-dimethoxy-5,6-dimethyl-3-[(1R,2S)-2-nitrocyclohexyl]-1,4-dioxan-2-one Traditional Name: (3S,5R,6R)-5,6-dimethoxy-5,6-dimethyl-3-[(1R,2S)-2-nitrocyclohexyl]-1,4-dioxan-2-one Formula: C14H23NO7 MolecularWeight: 317.33492

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC(=O)C(O1)C2CCCCC2[N+](=O)[O-])(C)OC)OC

Isomeric SMILES

C[C@@]1([C@](OC(=O)[C@@H](O1)[C@@H]2CCCC[C@@H]2[N+](=O)[O-])(C)OC)OC

InChI

InChI=1S/C14H23NO7/c1-13(19-3)14(2,20-4)22-12(16)11(21-13)9-7-5-6-8-10(9)15(17)18/h9-11H,5-8H2,1-4H3/t9-,10+,11+,13-,14-/m1/s1