(2S)-2-methoxy-5-(5-nitroindazol-1-yl)pentane-1,3-diol

Systemtic Name: (2S)-2-methoxy-5-(5-nitroindazol-1-yl)pentane-1,3-diol Openeye Name: (2S)-2-methoxy-5-(5-nitroindazol-1-yl)pentane-1,3-diol CAS Name: (2S)-2-methoxy-5-(5-nitro-1-indazolyl)pentane-1,3-diol IUPAC Name: (2S)-2-methoxy-5-(5-nitroindazol-1-yl)pentane-1,3-diol Traditional Name: (2S)-2-methoxy-5-(5-nitroindazol-1-yl)pentane-1,3-diol Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

COC(CO)C(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=N1)O

Isomeric SMILES

CO[C@@H](CO)C(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=N1)O

InChI

InChI=1S/C13H17N3O5/c1-21-13(8-17)12(18)4-5-15-11-3-2-10(16(19)20)6-9(11)7-14-15/h2-3,6-7,12-13,17-18H,4-5,8H2,1H3/t12?,13-/m0/s1