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

Systemtic Name: dimethyl-[(1S,2R)-1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]azanium Openeye Name: [(1R,2S)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-dimethylammonium IUPAC Name: [(1S,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-dimethylazanium Traditional Name: [(1R,2S)-2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]-dimethyl-ammonium Formula: C11H17N2O4+ MolecularWeight: 241.26368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O4/c1-12(2)10(7-14)11(15)8-3-5-9(6-4-8)13(16)17/h3-6,10-11,14-15H,7H2,1-2H3/p+1/t10-,11+/m1/s1