1-(methylamino)-3-(4-nitrophenyl)propane-1,2,3-triol

Systemtic Name: 1-(methylamino)-3-(4-nitrophenyl)propane-1,2,3-triol Openeye Name: 1-(methylamino)-3-(4-nitrophenyl)propane-1,2,3-triol CAS Name: 1-(methylamino)-3-(4-nitrophenyl)propane-1,2,3-triol IUPAC Name: 1-(methylamino)-3-(4-nitrophenyl)propane-1,2,3-triol Traditional Name: 1-(methylamino)-3-(4-nitrophenyl)propane-1,2,3-triol Formula: C10H14N2O5 MolecularWeight: 242.22856

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Descriptors Computed from Structure

Canonical SMILES:

CNC(C(C(C1=CC=C(C=C1)[N+](=O)[O-])O)O)O

Isomeric SMILES

CNC(C(C(C1=CC=C(C=C1)[N+](=O)[O-])O)O)O

InChI

InChI=1S/C10H14N2O5/c1-11-10(15)9(14)8(13)6-2-4-7(5-3-6)12(16)17/h2-5,8-11,13-15H,1H3