(2R)-2-azaniumyl-3-(2,4-dinitrophenyl)propanoate

Systemtic Name: (2R)-2-azaniumyl-3-(2,4-dinitrophenyl)propanoate Openeye Name: (2R)-2-azaniumyl-3-(2,4-dinitrophenyl)propanoate CAS Name: (2R)-2-ammonio-3-(2,4-dinitrophenyl)propanoate IUPAC Name: (2R)-2-azaniumyl-3-(2,4-dinitrophenyl)propanoate Traditional Name: (2R)-2-ammonio-3-(2,4-dinitrophenyl)propionate Formula: C9H9N3O6 MolecularWeight: 255.18426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9N3O6/c10-7(9(13)14)3-5-1-2-6(11(15)16)4-8(5)12(17)18/h1-2,4,7H,3,10H2,(H,13,14)/t7-/m1/s1