2-[(2,3-dinitrophenyl)amino]propanoic acid

Systemtic Name: 2-[(2,3-dinitrophenyl)amino]propanoic acid Openeye Name: 2-(2,3-dinitroanilino)propanoic acid CAS Name: 2-(2,3-dinitroanilino)propanoic acid IUPAC Name: 2-(2,3-dinitroanilino)propanoic acid Traditional Name: 2-(2,3-dinitroanilino)propionic acid Formula: C9H9N3O6 MolecularWeight: 255.18426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O6/c1-5(9(13)14)10-6-3-2-4-7(11(15)16)8(6)12(17)18/h2-5,10H,1H3,(H,13,14)