(2R,4aR,6R,7R,8S,8aS)-6-dodecoxy-7-nitro-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol

Systemtic Name: (2R,4aR,6R,7R,8S,8aS)-6-dodecoxy-7-nitro-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol Openeye Name: (2R,4aR,6R,7R,8S,8aS)-6-dodecoxy-7-nitro-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol CAS Name: (2R,4aR,6R,7R,8S,8aS)-6-dodecoxy-7-nitro-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol IUPAC Name: (2R,4aR,6R,7R,8S,8aS)-6-dodecoxy-7-nitro-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol Traditional Name: (2R,4aR,6R,7R,8S,8aS)-6-lauryloxy-7-nitro-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-ol Formula: C25H39NO7 MolecularWeight: 465.57966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCO[C@H]1[C@@H]([C@@H]([C@H]2[C@H](O1)CO[C@H](O2)C3=CC=CC=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C25H39NO7/c1-2-3-4-5-6-7-8-9-10-14-17-30-25-21(26(28)29)22(27)23-20(32-25)18-31-24(33-23)19-15-12-11-13-16-19/h11-13,15-16,20-25,27H,2-10,14,17-18H2,1H3/t20-,21-,22+,23-,24-,25-/m1/s1