4-[(2,4-dinitrophenyl)amino]-2-(hydroxymethyl)-6-methoxy-oxane-3,5-diol

Systemtic Name: 4-[(2,4-dinitrophenyl)amino]-2-(hydroxymethyl)-6-methoxy-oxane-3,5-diol Openeye Name: 4-(2,4-dinitroanilino)-2-(hydroxymethyl)-6-methoxy-tetrahydropyran-3,5-diol CAS Name: 4-(2,4-dinitroanilino)-2-(hydroxymethyl)-6-methoxyoxane-3,5-diol IUPAC Name: 4-(2,4-dinitroanilino)-2-(hydroxymethyl)-6-methoxyoxane-3,5-diol Traditional Name: 4-(2,4-dinitroanilino)-2-methoxy-6-methylol-tetrahydropyran-3,5-diol Formula: C13H17N3O9 MolecularWeight: 359.28878

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)CO)O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

COC1C(C(C(C(O1)CO)O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C13H17N3O9/c1-24-13-12(19)10(11(18)9(5-17)25-13)14-7-3-2-6(15(20)21)4-8(7)16(22)23/h2-4,9-14,17-19H,5H2,1H3