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

Systemtic Name: [1-(2-nitrophenyl)-1,3-bis(oxidanyl)-3-oxidanylidene-propan-2-yl]azanium chloride Openeye Name: [1-carboxy-2-hydroxy-2-(2-nitrophenyl)ethyl]ammonium chloride CAS Name: [1,3-dihydroxy-1-(2-nitrophenyl)-3-oxopropan-2-yl]ammonium chloride IUPAC Name: [1,3-dihydroxy-1-(2-nitrophenyl)-3-oxopropan-2-yl]azanium chloride Traditional Name: [1-carboxy-2-hydroxy-2-(2-nitrophenyl)ethyl]ammonium chloride Formula: C9H11ClN2O5 MolecularWeight: 262.64704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O5.ClH/c10-7(9(13)14)8(12)5-3-1-2-4-6(5)11(15)16;/h1-4,7-8,12H,10H2,(H,13,14);1H