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

Systemtic Name: [(1R,2S)-1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]azanium Openeye Name: [(1S,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]ammonium CAS Name: [(1R,2S)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]ammonium IUPAC Name: [(1R,2S)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]azanium Traditional Name: [(1S,2R)-2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]ammonium Formula: C9H13N2O4+ MolecularWeight: 213.21052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC=C1[C@H]([C@H](CO)[NH3+])O)[N+](=O)[O-]

InChI

InChI=1S/C9H12N2O4/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15/h1-4,8-9,12-13H,5,10H2/p+1/t8-,9+/m0/s1