[1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]azanium chloride

Systemtic Name: [1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]azanium chloride Openeye Name: [2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]ammonium chloride CAS Name: [1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]ammonium chloride IUPAC Name: [1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]azanium chloride Traditional Name: [2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]ammonium chloride Formula: C9H13ClN2O4 MolecularWeight: 248.66352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(CO)[NH3+])O)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC(=CC=C1C(C(CO)[NH3+])O)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C9H12N2O4.ClH/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15;/h1-4,8-9,12-13H,5,10H2;1H