(2S)-3-(5-nitro-2-pyrrolidin-1-yl-phenoxy)propane-1,2-diol

Systemtic Name: (2S)-3-(5-nitro-2-pyrrolidin-1-yl-phenoxy)propane-1,2-diol Openeye Name: (2S)-3-(5-nitro-2-pyrrolidin-1-yl-phenoxy)propane-1,2-diol CAS Name: (2S)-3-[5-nitro-2-(1-pyrrolidinyl)phenoxy]propane-1,2-diol IUPAC Name: (2S)-3-(5-nitro-2-pyrrolidin-1-ylphenoxy)propane-1,2-diol Traditional Name: (2S)-3-(5-nitro-2-pyrrolidino-phenoxy)propane-1,2-diol Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])OCC(CO)O

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])OC[C@H](CO)O

InChI

InChI=1S/C13H18N2O5/c16-8-11(17)9-20-13-7-10(15(18)19)3-4-12(13)14-5-1-2-6-14/h3-4,7,11,16-17H,1-2,5-6,8-9H2/t11-/m0/s1