4-(hydroxymethyl)-6-(2-nitro-1-oxidanyl-ethyl)-2-phenyl-1,3-dioxan-5-ol

Systemtic Name: 4-(hydroxymethyl)-6-(2-nitro-1-oxidanyl-ethyl)-2-phenyl-1,3-dioxan-5-ol Openeye Name: 4-(hydroxymethyl)-6-(1-hydroxy-2-nitro-ethyl)-2-phenyl-1,3-dioxan-5-ol CAS Name: 4-(hydroxymethyl)-6-(1-hydroxy-2-nitroethyl)-2-phenyl-1,3-dioxan-5-ol IUPAC Name: 4-(hydroxymethyl)-6-(1-hydroxy-2-nitroethyl)-2-phenyl-1,3-dioxan-5-ol Traditional Name: 4-(1-hydroxy-2-nitro-ethyl)-6-methylol-2-phenyl-1,3-dioxan-5-ol Formula: C13H17NO7 MolecularWeight: 299.27658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2OC(C(C(O2)C(C[N+](=O)[O-])O)O)CO

Isomeric SMILES

C1=CC=C(C=C1)C2OC(C(C(O2)C(C[N+](=O)[O-])O)O)CO

InChI

InChI=1S/C13H17NO7/c15-7-10-11(17)12(9(16)6-14(18)19)21-13(20-10)8-4-2-1-3-5-8/h1-5,9-13,15-17H,6-7H2